2-(1H-benzimidazol-2-ylsulfanyl)-1-(3,4-dimethoxy-2-oxidanyl-phenyl)ethanone

Systemtic Name: 2-(1H-benzimidazol-2-ylsulfanyl)-1-(3,4-dimethoxy-2-oxidanyl-phenyl)ethanone Openeye Name: 2-(1H-benzimidazol-2-ylsulfanyl)-1-(2-hydroxy-3,4-dimethoxy-phenyl)ethanone CAS Name: 2-(1H-benzimidazol-2-ylthio)-1-(2-hydroxy-3,4-dimethoxyphenyl)ethanone IUPAC Name: 2-(1H-benzimidazol-2-ylsulfanyl)-1-(2-hydroxy-3,4-dimethoxyphenyl)ethanone Traditional Name: 2-(1H-benzimidazol-2-ylthio)-1-(2-hydroxy-3,4-dimethoxy-phenyl)ethanone Formula: C17H16N2O4S MolecularWeight: 344.38494

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C(=O)CSC2=NC3=CC=CC=C3N2)O)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)C(=O)CSC2=NC3=CC=CC=C3N2)O)OC

InChI

InChI=1S/C17H16N2O4S/c1-22-14-8-7-10(15(21)16(14)23-2)13(20)9-24-17-18-11-5-3-4-6-12(11)19-17/h3-8,21H,9H2,1-2H3,(H,18,19)