N-(3,4-diethoxyphenyl)-2-[1-(2-methylpropyl)benzimidazol-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(3,4-diethoxyphenyl)-2-[1-(2-methylpropyl)benzimidazol-2-yl]sulfanyl-ethanamide Openeye Name: N-(3,4-diethoxyphenyl)-2-(1-isobutylbenzimidazol-2-yl)sulfanyl-acetamide CAS Name: N-(3,4-diethoxyphenyl)-2-[[1-(2-methylpropyl)-2-benzimidazolyl]thio]acetamide IUPAC Name: N-(3,4-diethoxyphenyl)-2-[1-(2-methylpropyl)benzimidazol-2-yl]sulfanylacetamide Traditional Name: N-(3,4-diethoxyphenyl)-2-[(1-isobutylbenzimidazol-2-yl)thio]acetamide Formula: C23H29N3O3S MolecularWeight: 427.55966

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3N2CC(C)C)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3N2CC(C)C)OCC

InChI

InChI=1S/C23H29N3O3S/c1-5-28-20-12-11-17(13-21(20)29-6-2)24-22(27)15-30-23-25-18-9-7-8-10-19(18)26(23)14-16(3)4/h7-13,16H,5-6,14-15H2,1-4H3,(H,24,27)