N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(1-phenylbenzimidazol-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(1-phenylbenzimidazol-2-yl)sulfanyl-ethanamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(1-phenylbenzimidazol-2-yl)sulfanyl-acetamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(1-phenyl-2-benzimidazolyl)thio]acetamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(1-phenylbenzimidazol-2-yl)sulfanylacetamide Traditional Name: N-homoveratryl-2-[(1-phenylbenzimidazol-2-yl)thio]acetamide Formula: C25H25N3O3S MolecularWeight: 447.5493

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)CSC2=NC3=CC=CC=C3N2C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)CSC2=NC3=CC=CC=C3N2C4=CC=CC=C4)OC

InChI

InChI=1S/C25H25N3O3S/c1-30-22-13-12-18(16-23(22)31-2)14-15-26-24(29)17-32-25-27-20-10-6-7-11-21(20)28(25)19-8-4-3-5-9-19/h3-13,16H,14-15,17H2,1-2H3,(H,26,29)