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Sulfinylbenzimidazoles
Description:
Polycyclic aromatic compounds containing a sulfinyl group attached at the position 2 of a benzimidazole moiety.
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Triclabendazole sulfoxideCas Number: 100648-13-3 Compound CID: 127657Formula: C14H9Cl3N2O2S Molecular Weight: 375.66IUPAC Name: 6-chloro-5-(2,3-dichlorophenoxy)-2-methylsulfinyl-1H-benzimidazoleSMILES: CS(=O)C1=NC2=CC(=C(C=C2N1)Cl)OC3=C(C(=CC=C3)Cl)ClInChIKey: GABQPFWIQFRJSE-UHFFFAOYSA-NInChI: InChI=1S/C14H9Cl3N2O2S/c1-22(20)14-18-9-5-8(16)12(6-10(9)19-14)21-11-4-2-3-7(15)13(11)17/h2-6H,1H3,(H,18,19) -
Triclabendazole sulfoneCas Number: 106791-37-1 Compound CID: 10340439Formula: C14H9Cl3N2O3S Molecular Weight: 391.66IUPAC Name: 6-chloro-5-(2,3-dichlorophenoxy)-2-methylsulfonyl-1H-benzimidazoleSMILES: CS(=O)(=O)C1=NC2=CC(=C(C=C2N1)Cl)OC3=C(C(=CC=C3)Cl)ClInChIKey: ZEIHWBIRYIXBSV-UHFFFAOYSA-NInChI: InChI=1S/C14H9Cl3N2O3S/c1-23(20,21)14-18-9-5-8(16)12(6-10(9)19-14)22-11-4-2-3-7(15)13(11)17/h2-6H,1H3,(H,18,19)
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Lansoprazole sodiumCas Number: 226904-00-3Formula: C16H13F3N3NaO2S Molecular Weight: 391.34SMILES: CC1=C(C=CN=C1CS(=O)C2=NC3=CC=CC=C3[N-]2)OCC(F)(F)F.[Na+]InChIKey: OTGPYEHFRKGRIZ-UHFFFAOYSA-NInChI: InChI=1S/C16H13F3N3O2S.Na/c1-10-13(20-7-6-14(10)24-9-16(17,18)19)8-25(23)15-21-11-4-2-3-5-12(11)22-15;/h2-7H,8-9H2,1H3;/q-1;+1
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4-Desmethoxy OmeprazoleCas Number: 110374-16-8 Compound CID: 46781146Formula: C16H17N3O2S Molecular Weight: 315.39IUPAC Name: 2-[(3,5-dimethylpyridin-2-yl)methylsulfinyl]-6-methoxy-1H-benzimidazoleSMILES: CC1=CC(=C(N=C1)CS(=O)C2=NC3=C(N2)C=C(C=C3)OC)CInChIKey: ZMXZYNHJPJEPAE-UHFFFAOYSA-NInChI: InChI=1S/C16H17N3O2S/c1-10-6-11(2)15(17-8-10)9-22(20)16-18-13-5-4-12(21-3)7-14(13)19-16/h4-8H,9H2,1-3H3,(H,18,19)
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5-HydroxylansoprazoleCas Number: 131926-98-2 Compound CID: 9800271IUPAC Name: 2-[[3-methyl-4-(2,2,2-trifluoroethoxy)pyridin-2-yl]methylsulfinyl]-3H-benzimidazol-5-olSMILES: CC1=C(C=CN=C1CS(=O)C2=NC3=C(N2)C=C(C=C3)O)OCC(F)(F)FInChIKey: IDCLTMRSSAXUNY-UHFFFAOYSA-NInChI: InChI=1S/C16H14F3N3O3S/c1-9-13(20-5-4-14(9)25-8-16(17,18)19)7-26(24)15-21-11-3-2-10(23)6-12(11)22-15/h2-6,23H,7-8H2,1H3,(H,21,22)
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2-(((4-(3-methoxypropoxy)-3-methylpyridin-2-yl)methyl)sulfonyl)-1H-benzo[d]imidazole(RabeprazoleImpurity)Cas Number: 117976-47-3 Compound CID: 11740183IUPAC Name: 2-[[4-(3-methoxypropoxy)-3-methylpyridin-2-yl]methylsulfonyl]-1H-benzimidazoleSMILES: CC1=C(C=CN=C1CS(=O)(=O)C2=NC3=CC=CC=C3N2)OCCCOCInChIKey: KNYNPBSPFHFPML-UHFFFAOYSA-NInChI: InChI=1S/C18H21N3O4S/c1-13-16(19-9-8-17(13)25-11-5-10-24-2)12-26(22,23)18-20-14-6-3-4-7-15(14)21-18/h3-4,6-9H,5,10-12H2,1-2H3,(H,20,21)
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(R)-5-Methoxy-2-(((4-methoxy-3，5-dimethylpyridin-2-yl)methyl)sulfinyl)-1H-benzo[d]imidazoleCas Number: 119141-89-8 EC Number: 643-098-6IUPAC Name: 6-methoxy-2-[(R)-(4-methoxy-3,5-dimethylpyridin-2-yl)methylsulfinyl]-1H-benzimidazoleSMILES: CC1=CN=C(C(=C1OC)C)CS(=O)C2=NC3=C(N2)C=C(C=C3)OCInChIKey: SUBDBMMJDZJVOS-XMMPIXPASA-NInChI: InChI=1S/C17H19N3O3S/c1-10-8-18-15(11(2)16(10)23-4)9-24(21)17-19-13-6-5-12(22-3)7-14(13)20-17/h5-8H,9H2,1-4H3,(H,19,20)/t24-/m1/s1
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PicoprazoleCas Number: 78090-11-6IUPAC Name: methyl 6-methyl-2-[(3-methylpyridin-2-yl)methylsulfinyl]-1H-benzimidazole-5-carboxylateSMILES: CC1=C(N=CC=C1)CS(=O)C2=NC3=C(N2)C=C(C(=C3)C(=O)OC)CInChIKey: ASSMECARUIRCML-UHFFFAOYSA-NInChI: InChI=1S/C17H17N3O3S/c1-10-5-4-6-18-15(10)9-24(22)17-19-13-7-11(2)12(16(21)23-3)8-14(13)20-17/h4-8H,9H2,1-3H3,(H,19,20)
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5-hydroxy OmeprazoleCas Number: 92340-57-3 Compound CID: 119560Formula: C17H19N3O4S Molecular Weight: 361.42IUPAC Name: [4-methoxy-6-[(6-methoxy-1H-benzimidazol-2-yl)sulfinylmethyl]-5-methylpyridin-3-yl]methanolSMILES: CC1=C(C(=CN=C1CS(=O)C2=NC3=C(N2)C=C(C=C3)OC)CO)OCInChIKey: CMZHQFXXAAIBKE-UHFFFAOYSA-NInChI: InChI=1S/C17H19N3O4S/c1-10-15(18-7-11(8-21)16(10)24-3)9-25(22)17-19-13-5-4-12(23-2)6-14(13)20-17/h4-7,21H,8-9H2,1-3H3,(H,19,20)
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2-(Benzylsulfonyl)-1H-benzo[d]imidazoleCas Number: 100872-42-2 Compound CID: 563345Formula: C14H12N2O2S Molecular Weight: 272.32IUPAC Name: 2-benzylsulfonyl-1H-benzimidazoleSMILES: C1=CC=C(C=C1)CS(=O)(=O)C2=NC3=CC=CC=C3N2InChIKey: CCNODZZYRVNSFO-UHFFFAOYSA-NInChI: InChI=1S/C14H12N2O2S/c17-19(18,10-11-6-2-1-3-7-11)14-15-12-8-4-5-9-13(12)16-14/h1-9H,10H2,(H,15,16)
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1-Benzyl-1H-benzimidazole-2-sulfonic acidCas Number: 90331-20-7 Compound CID: 2772580Formula: C14H12N2O3SIUPAC Name: 1-benzylbenzimidazole-2-sulfonic acidSMILES: C1=CC=C(C=C1)CN2C3=CC=CC=C3N=C2S(=O)(=O)OInChIKey: HGYLMBSADYHHGI-UHFFFAOYSA-NInChI: InChI=1S/C14H12N2O3S/c17-20(18,19)14-15-12-8-4-5-9-13(12)16(14)10-11-6-2-1-3-7-11/h1-9H,10H2,(H,17,18,19)
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Esomeprazole strontiumCas Number: 934714-36-0Formula: C34H44N6O10S2Sr Molecular Weight: 848.5IUPAC Name: strontium;5-methoxy-2-[(S)-(4-methoxy-3,5-dimethylpyridin-2-yl)methylsulfinyl]benzimidazol-1-ide;tetrahydrateSMILES: CC1=CN=C(C(=C1OC)C)CS(=O)C2=NC3=C([N-]2)C=CC(=C3)OC.CC1=CN=C(C(=C1OC)C)CS(=O)C2=NC3=C([N-]2)C=CC(=C3)OC.O.O.O.O.[Sr+2]InChIKey: NCGHIAKEJNQSMS-QLGOZJDFSA-NInChI: show more Synonyms: ESOMEPRAZOLE STRONTIUM | ESOMEPRAZOLE STRONTIUM [VANDF] | (-)-5-Methoxy-2-((S)-((4-methoxy-3,5-dimethylpyridin-2-yl)m...
