2-(1H-benzimidazol-2-ylmethylsulfanyl)-N-(5-ethylsulfonyl-2-oxidanyl-phenyl)ethanamide

Systemtic Name: 2-(1H-benzimidazol-2-ylmethylsulfanyl)-N-(5-ethylsulfonyl-2-oxidanyl-phenyl)ethanamide Openeye Name: 2-(1H-benzimidazol-2-ylmethylsulfanyl)-N-(5-ethylsulfonyl-2-hydroxy-phenyl)acetamide CAS Name: 2-(1H-benzimidazol-2-ylmethylthio)-N-(5-ethylsulfonyl-2-hydroxyphenyl)acetamide IUPAC Name: 2-(1H-benzimidazol-2-ylmethylsulfanyl)-N-(5-ethylsulfonyl-2-hydroxyphenyl)acetamide Traditional Name: 2-(1H-benzimidazol-2-ylmethylthio)-N-(5-esyl-2-hydroxy-phenyl)acetamide Formula: C18H19N3O4S2 MolecularWeight: 405.49116

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC(=C(C=C1)O)NC(=O)CSCC2=NC3=CC=CC=C3N2

Isomeric SMILES

CCS(=O)(=O)C1=CC(=C(C=C1)O)NC(=O)CSCC2=NC3=CC=CC=C3N2

InChI

InChI=1S/C18H19N3O4S2/c1-2-27(24,25)12-7-8-16(22)15(9-12)21-18(23)11-26-10-17-19-13-5-3-4-6-14(13)20-17/h3-9,22H,2,10-11H2,1H3,(H,19,20)(H,21,23)