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Benzimidazoles

Benzimidazoles

Aromatic organic heterocyclic compounds that consist of benzene fused with an imidazole; imidazoles are a diazole with non-adjacent nitrogen atoms.
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1

1-Methyl-2-(methylsulfonyl)benzimidazole 98.0+%, TCI America™

CAS: 61078-14-6 Molecular Formula: C9H10N2O2S Molecular Weight (g/mol): 210.251 InChI Key: VDZVTXFWEKBHBV-UHFFFAOYSA-N PubChem CID: 640715 IUPAC Name: 1-methyl-2-methylsulfonylbenzimidazole SMILES: CN1C2=CC=CC=C2N=C1S(=O)(=O)C

PubChem CID 640715
CAS 61078-14-6
Molecular Weight (g/mol) 210.251
SMILES CN1C2=CC=CC=C2N=C1S(=O)(=O)C
IUPAC Name 1-methyl-2-methylsulfonylbenzimidazole
InChI Key VDZVTXFWEKBHBV-UHFFFAOYSA-N
Molecular Formula C9H10N2O2S
2

Omeprazole, USP, 98-102%, Spectrum™ Chemical
SDP

CAS: 73590-58-6 Molecular Formula: C17H19N3O3S Molecular Weight (g/mol): 345.42 InChI Key: SUBDBMMJDZJVOS-UHFFFAOYNA-N IUPAC Name: 6-methoxy-2-[(4-methoxy-3,5-dimethylpyridin-2-yl)methanesulfinyl]-1H-1,3-benzodiazole SMILES: COC1=CC=C2N=C(NC2=C1)S(=O)CC1=NC=C(C)C(OC)=C1C

CAS 73590-58-6
Molecular Weight (g/mol) 345.42
SMILES COC1=CC=C2N=C(NC2=C1)S(=O)CC1=NC=C(C)C(OC)=C1C
IUPAC Name 6-methoxy-2-[(4-methoxy-3,5-dimethylpyridin-2-yl)methanesulfinyl]-1H-1,3-benzodiazole
InChI Key SUBDBMMJDZJVOS-UHFFFAOYNA-N
Molecular Formula C17H19N3O3S
3

Albendazole 98.0+%, TCI America™

CAS: 54965-21-8 Molecular Formula: C12H15N3O2S Molecular Weight (g/mol): 265.33 MDL Number: MFCD00083232 InChI Key: HXHWSAZORRCQMX-UHFFFAOYSA-N Synonym: albendazole,albenza,eskazole,valbazen,zentel,albendazol,proftril,albendazolum,bilutac,zental PubChem CID: 2082 ChEBI: CHEBI:16664 IUPAC Name: methyl N-[6-(propylsulfanyl)-1H-1,3-benzodiazol-2-yl]carbamate SMILES: CCCSC1=CC=C2N=C(NC(=O)OC)NC2=C1

PubChem CID 2082
CAS 54965-21-8
Molecular Weight (g/mol) 265.33
ChEBI CHEBI:16664
MDL Number MFCD00083232
SMILES CCCSC1=CC=C2N=C(NC(=O)OC)NC2=C1
Synonym albendazole,albenza,eskazole,valbazen,zentel,albendazol,proftril,albendazolum,bilutac,zental
IUPAC Name methyl N-[6-(propylsulfanyl)-1H-1,3-benzodiazol-2-yl]carbamate
InChI Key HXHWSAZORRCQMX-UHFFFAOYSA-N
Molecular Formula C12H15N3O2S
4

Albendazole sulfone, Thermo Scientific Chemicals

CAS: 75184-71-3 Molecular Formula: C12H15N3O4S Molecular Weight (g/mol): 297.33 MDL Number: MFCD00600775 InChI Key: CLSJYOLYMZNKJB-UHFFFAOYSA-N Synonym: albendazole sulfone,unii-1uic88380g,methyl 5-propylsulfonyl 2-benzimidazolecarbamate,methyl 5-propylsulfonyl-1h-benzimidazol-2-yl carbamate,methyl-5-propylsulfonyl-1h-benzimidazol-2-yl carbamate,5-propylsulfonyl-2-benzimidazolecarbamic acid methyl ester,methyl 6-propylsulfonyl-1h-benzo d imidazol-2-yl carbamate,methyl n-5-propane-1-sulfonyl-1h-1,3-benzodiazol-2-yl carbamate,2-benzimidazolecarbamic acid, 5-propylsulfonyl-, methyl ester PubChem CID: 53174 ChEBI: CHEBI:80620 IUPAC Name: methyl N-[6-(propane-1-sulfonyl)-1H-1,3-benzodiazol-2-yl]carbamate SMILES: CCCS(=O)(=O)C1=CC=C2N=C(NC(=O)OC)NC2=C1

PubChem CID 53174
CAS 75184-71-3
Molecular Weight (g/mol) 297.33
ChEBI CHEBI:80620
MDL Number MFCD00600775
SMILES CCCS(=O)(=O)C1=CC=C2N=C(NC(=O)OC)NC2=C1
Synonym albendazole sulfone,unii-1uic88380g,methyl 5-propylsulfonyl 2-benzimidazolecarbamate,methyl 5-propylsulfonyl-1h-benzimidazol-2-yl carbamate,methyl-5-propylsulfonyl-1h-benzimidazol-2-yl carbamate,5-propylsulfonyl-2-benzimidazolecarbamic acid methyl ester,methyl 6-propylsulfonyl-1h-benzo d imidazol-2-yl carbamate,methyl n-5-propane-1-sulfonyl-1h-1,3-benzodiazol-2-yl carbamate,2-benzimidazolecarbamic acid, 5-propylsulfonyl-, methyl ester
IUPAC Name methyl N-[6-(propane-1-sulfonyl)-1H-1,3-benzodiazol-2-yl]carbamate
InChI Key CLSJYOLYMZNKJB-UHFFFAOYSA-N
Molecular Formula C12H15N3O4S
5

Lansoprazole 98.0+%, TCI America™

CAS: 103577-45-3 Molecular Formula: C16H14F3N3O2S Molecular Weight (g/mol): 369.362 MDL Number: MFCD00866873 InChI Key: MJIHNNLFOKEZEW-UHFFFAOYSA-N Synonym: lansoprazole,prevacid,bamalite,monolitum,lansoprazol,agopton,limpidex,ogastro,lanzor,opiren PubChem CID: 3883 ChEBI: CHEBI:6375 IUPAC Name: 2-[[3-methyl-4-(2,2,2-trifluoroethoxy)pyridin-2-yl]methylsulfinyl]-1H-benzimidazole SMILES: CC1=C(C=CN=C1CS(=O)C2=NC3=CC=CC=C3N2)OCC(F)(F)F

PubChem CID 3883
CAS 103577-45-3
Molecular Weight (g/mol) 369.362
ChEBI CHEBI:6375
MDL Number MFCD00866873
SMILES CC1=C(C=CN=C1CS(=O)C2=NC3=CC=CC=C3N2)OCC(F)(F)F
Synonym lansoprazole,prevacid,bamalite,monolitum,lansoprazol,agopton,limpidex,ogastro,lanzor,opiren
IUPAC Name 2-[[3-methyl-4-(2,2,2-trifluoroethoxy)pyridin-2-yl]methylsulfinyl]-1H-benzimidazole
InChI Key MJIHNNLFOKEZEW-UHFFFAOYSA-N
Molecular Formula C16H14F3N3O2S
6

Albendazole, 98+%, Thermo Scientific Chemicals

CAS: 54965-21-8 Molecular Formula: C12H15N3O2S Molecular Weight (g/mol): 265.33 MDL Number: MFCD00083232 InChI Key: HXHWSAZORRCQMX-UHFFFAOYSA-N Synonym: albendazole,albenza,eskazole,valbazen,zentel,albendazol,proftril,albendazolum,bilutac,zental PubChem CID: 2082 ChEBI: CHEBI:16664 IUPAC Name: methyl N-(6-propylsulfanyl-1H-benzimidazol-2-yl)carbamate SMILES: CCCSC1=CC=C2N=C(NC(=O)OC)NC2=C1

PubChem CID 2082
CAS 54965-21-8
Molecular Weight (g/mol) 265.33
ChEBI CHEBI:16664
MDL Number MFCD00083232
SMILES CCCSC1=CC=C2N=C(NC(=O)OC)NC2=C1
Synonym albendazole,albenza,eskazole,valbazen,zentel,albendazol,proftril,albendazolum,bilutac,zental
IUPAC Name methyl N-(6-propylsulfanyl-1H-benzimidazol-2-yl)carbamate
InChI Key HXHWSAZORRCQMX-UHFFFAOYSA-N
Molecular Formula C12H15N3O2S
7

Omeprazole, USP, 98-102%, Spectrum™ Chemical
SDP

CAS: 73590-58-6 Molecular Formula: C17H19N3O3S Molecular Weight (g/mol): 345.42 InChI Key: SUBDBMMJDZJVOS-UHFFFAOYNA-N IUPAC Name: 6-methoxy-2-[(4-methoxy-3,5-dimethylpyridin-2-yl)methanesulfinyl]-1H-1,3-benzodiazole SMILES: COC1=CC=C2N=C(NC2=C1)S(=O)CC1=NC=C(C)C(OC)=C1C

CAS 73590-58-6
Molecular Weight (g/mol) 345.42
SMILES COC1=CC=C2N=C(NC2=C1)S(=O)CC1=NC=C(C)C(OC)=C1C
IUPAC Name 6-methoxy-2-[(4-methoxy-3,5-dimethylpyridin-2-yl)methanesulfinyl]-1H-1,3-benzodiazole
InChI Key SUBDBMMJDZJVOS-UHFFFAOYNA-N
Molecular Formula C17H19N3O3S
8

Pantoprazole sodium salt hydrate, Thermo Scientific Chemicals

CAS: 718635-09-7 Molecular Formula: C16H14F2N3NaO4S Molecular Weight (g/mol): 405.35 MDL Number: MFCD08704580 InChI Key: YNWDKZIIWCEDEE-UHFFFAOYNA-N Synonym: pantoprazole sodium,pantoprazole sodium hydrate,pantozol hydrate,protonix hydrate,c16h14f2n3nao4s.h2o,sodium pantoprazole 1-hydrate,pantoprazole sodium hydrate hplc,5-difluoromethoxy-2-3,4-dimethoxypyridin-2-yl methanesulfinyl-1-sodio-1,3-benzodiazole hydrate,5-difluoromethoxy-2-3,4-dimethoxy-2-pyridinyl methyl sulfinyl-1h-benzimidazole sodium salt hydrate PubChem CID: 23684923 IUPAC Name: sodium;5-(difluoromethoxy)-2-[(3,4-dimethoxypyridin-2-yl)methylsulfinyl]benzimidazol-1-ide;hydrate SMILES: [Na+].COC1=C(OC)C(CS(=O)C2=NC3=CC(OC(F)F)=CC=C3[N-]2)=NC=C1

PubChem CID 23684923
CAS 718635-09-7
Molecular Weight (g/mol) 405.35
MDL Number MFCD08704580
SMILES [Na+].COC1=C(OC)C(CS(=O)C2=NC3=CC(OC(F)F)=CC=C3[N-]2)=NC=C1
Synonym pantoprazole sodium,pantoprazole sodium hydrate,pantozol hydrate,protonix hydrate,c16h14f2n3nao4s.h2o,sodium pantoprazole 1-hydrate,pantoprazole sodium hydrate hplc,5-difluoromethoxy-2-3,4-dimethoxypyridin-2-yl methanesulfinyl-1-sodio-1,3-benzodiazole hydrate,5-difluoromethoxy-2-3,4-dimethoxy-2-pyridinyl methyl sulfinyl-1h-benzimidazole sodium salt hydrate
IUPAC Name sodium;5-(difluoromethoxy)-2-[(3,4-dimethoxypyridin-2-yl)methylsulfinyl]benzimidazol-1-ide;hydrate
InChI Key YNWDKZIIWCEDEE-UHFFFAOYNA-N
Molecular Formula C16H14F2N3NaO4S
9

Omeprazole, 98%, Thermo Scientific Chemicals

CAS: 73590-58-6 Molecular Formula: C17H19N3O3S Molecular Weight (g/mol): 345.417 MDL Number: MFCD00083192 InChI Key: SUBDBMMJDZJVOS-UHFFFAOYSA-N Synonym: omeprazole,losec,prilosec,antra,esomeprazole,omeprazon,audazol,omapren,omepral,parizac PubChem CID: 4594 ChEBI: CHEBI:77260 IUPAC Name: 6-methoxy-2-[(4-methoxy-3,5-dimethylpyridin-2-yl)methylsulfinyl]-1H-benzimidazole SMILES: CC1=CN=C(C(=C1OC)C)CS(=O)C2=NC3=C(N2)C=C(C=C3)OC

PubChem CID 4594
CAS 73590-58-6
Molecular Weight (g/mol) 345.417
ChEBI CHEBI:77260
MDL Number MFCD00083192
SMILES CC1=CN=C(C(=C1OC)C)CS(=O)C2=NC3=C(N2)C=C(C=C3)OC
Synonym omeprazole,losec,prilosec,antra,esomeprazole,omeprazon,audazol,omapren,omepral,parizac
IUPAC Name 6-methoxy-2-[(4-methoxy-3,5-dimethylpyridin-2-yl)methylsulfinyl]-1H-benzimidazole
InChI Key SUBDBMMJDZJVOS-UHFFFAOYSA-N
Molecular Formula C17H19N3O3S
10

Thermo Scientific Chemicals Omeprazole, 98+%

CAS: 73590-58-6 Molecular Formula: C17H19N3O3S Molecular Weight (g/mol): 345.42 InChI Key: SUBDBMMJDZJVOS-UHFFFAOYSA-N Synonym: omeprazole,losec,prilosec,antra,esomeprazole,omeprazon,audazol,omapren,omepral,parizac PubChem CID: 4594 ChEBI: CHEBI:77260 IUPAC Name: 6-methoxy-2-[(4-methoxy-3,5-dimethylpyridin-2-yl)methylsulfinyl]-1H-benzimidazole SMILES: CC1=CN=C(C(=C1OC)C)CS(=O)C2=NC3=C(N2)C=C(C=C3)OC

PubChem CID 4594
CAS 73590-58-6
Molecular Weight (g/mol) 345.42
ChEBI CHEBI:77260
SMILES CC1=CN=C(C(=C1OC)C)CS(=O)C2=NC3=C(N2)C=C(C=C3)OC
Synonym omeprazole,losec,prilosec,antra,esomeprazole,omeprazon,audazol,omapren,omepral,parizac
IUPAC Name 6-methoxy-2-[(4-methoxy-3,5-dimethylpyridin-2-yl)methylsulfinyl]-1H-benzimidazole
InChI Key SUBDBMMJDZJVOS-UHFFFAOYSA-N
Molecular Formula C17H19N3O3S
11

Lansoprazole Impurity Standard, British Pharmacopoeia (BP) Reference Standard, MilliporeSigma™ Supelco™

This product is provided as delivered and specified by the issuing Pharmacopoeia. All information provided in support of this product, including SDS and any product information leaflets, has been developed and issued under the Authority of the issuing Pharmacopoeia.

12

Fenbendazole 98.0+%, TCI America™

CAS: 43210-67-9 Molecular Formula: C15H13N3O2S Molecular Weight (g/mol): 299.348 MDL Number: MFCD00144301 InChI Key: HDDSHPAODJUKPD-UHFFFAOYSA-N Synonym: Methyl [5-(Phenylthio)benzimidazol-2-yl]carbamate, [5-(Phenylthio)benzimidazol-2-yl]carbamic Acid Methyl Ester PubChem CID: 3334 ChEBI: CHEBI:77092 IUPAC Name: methyl N-(6-phenylsulfanyl-1H-benzimidazol-2-yl)carbamate SMILES: COC(=O)NC1=NC2=C(N1)C=C(C=C2)SC3=CC=CC=C3

PubChem CID 3334
CAS 43210-67-9
Molecular Weight (g/mol) 299.348
ChEBI CHEBI:77092
MDL Number MFCD00144301
SMILES COC(=O)NC1=NC2=C(N1)C=C(C=C2)SC3=CC=CC=C3
Synonym Methyl [5-(Phenylthio)benzimidazol-2-yl]carbamate, [5-(Phenylthio)benzimidazol-2-yl]carbamic Acid Methyl Ester
IUPAC Name methyl N-(6-phenylsulfanyl-1H-benzimidazol-2-yl)carbamate
InChI Key HDDSHPAODJUKPD-UHFFFAOYSA-N
Molecular Formula C15H13N3O2S
13

Oxibendazole 98.0+%, TCI America™

CAS: 20559-55-1 Molecular Formula: C12H15N3O3 Molecular Weight (g/mol): 249.27 MDL Number: MFCD00133728 InChI Key: RAOCRURYZCVHMG-UHFFFAOYSA-N Synonym: Methyl (5-Propoxy-1H-benzo[d]imidazol-2-yl)carbamate, (5-Propoxy-1H-benzimidazol-2-yl)carbamic Acid Methyl Ester PubChem CID: 4622 IUPAC Name: methyl N-(6-propoxy-1H-benzimidazol-2-yl)carbamate SMILES: CCCOC1=CC2=C(C=C1)N=C(N2)NC(=O)OC

PubChem CID 4622
CAS 20559-55-1
Molecular Weight (g/mol) 249.27
MDL Number MFCD00133728
SMILES CCCOC1=CC2=C(C=C1)N=C(N2)NC(=O)OC
Synonym Methyl (5-Propoxy-1H-benzo[d]imidazol-2-yl)carbamate, (5-Propoxy-1H-benzimidazol-2-yl)carbamic Acid Methyl Ester
IUPAC Name methyl N-(6-propoxy-1H-benzimidazol-2-yl)carbamate
InChI Key RAOCRURYZCVHMG-UHFFFAOYSA-N
Molecular Formula C12H15N3O3
14

Rabeprazole Sodium Salt 98.0+%, TCI America™

CAS: 117976-90-6 Molecular Formula: C18H20N3NaO3S Molecular Weight (g/mol): 381.43 MDL Number: MFCD02092688 InChI Key: KRCQSTCYZUOBHN-UHFFFAOYNA-N PubChem CID: 14720269 ChEBI: CHEBI:8769 IUPAC Name: sodium 2-{[4-(3-methoxypropoxy)-3-methylpyridin-2-yl]methanesulfinyl}-1H-1,3-benzodiazol-1-ide SMILES: [Na+].COCCCOC1=CC=NC(CS(=O)C2=NC3=CC=CC=C3[N-]2)=C1C

PubChem CID 14720269
CAS 117976-90-6
Molecular Weight (g/mol) 381.43
ChEBI CHEBI:8769
MDL Number MFCD02092688
SMILES [Na+].COCCCOC1=CC=NC(CS(=O)C2=NC3=CC=CC=C3[N-]2)=C1C
IUPAC Name sodium 2-{[4-(3-methoxypropoxy)-3-methylpyridin-2-yl]methanesulfinyl}-1H-1,3-benzodiazol-1-ide
InChI Key KRCQSTCYZUOBHN-UHFFFAOYNA-N
Molecular Formula C18H20N3NaO3S
15

Lansoprazole, USP, 98-102%, Spectrum™ Chemical
SDP

CAS: 103577-45-3 Molecular Formula: C16H14F3N3O2S Molecular Weight (g/mol): 369.36 InChI Key: MJIHNNLFOKEZEW-UHFFFAOYNA-N IUPAC Name: 2-{[3-methyl-4-(2,2,2-trifluoroethoxy)pyridin-2-yl]methanesulfinyl}-1H-1,3-benzodiazole SMILES: CC1=C(CS(=O)C2=NC3=CC=CC=C3N2)N=CC=C1OCC(F)(F)F

CAS 103577-45-3
Molecular Weight (g/mol) 369.36
SMILES CC1=C(CS(=O)C2=NC3=CC=CC=C3N2)N=CC=C1OCC(F)(F)F
IUPAC Name 2-{[3-methyl-4-(2,2,2-trifluoroethoxy)pyridin-2-yl]methanesulfinyl}-1H-1,3-benzodiazole
InChI Key MJIHNNLFOKEZEW-UHFFFAOYNA-N
Molecular Formula C16H14F3N3O2S