2-[2-[2-[(3,4-dimethylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylbenzimidazol-1-yl]-N-phenethyl-ethanamide

Systemtic Name: 2-[2-[2-[(3,4-dimethylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylbenzimidazol-1-yl]-N-phenethyl-ethanamide Openeye Name: 2-[2-[2-(3,4-dimethylanilino)-2-oxo-ethyl]sulfanylbenzimidazol-1-yl]-N-phenethyl-acetamide CAS Name: 2-[2-[[2-(3,4-dimethylanilino)-2-oxoethyl]thio]-1-benzimidazolyl]-N-phenethylacetamide IUPAC Name: 2-[2-[2-(3,4-dimethylanilino)-2-oxoethyl]sulfanylbenzimidazol-1-yl]-N-phenethylacetamide Traditional Name: 2-[2-[[2-(3,4-dimethylanilino)-2-keto-ethyl]thio]benzimidazol-1-yl]-N-phenethyl-acetamide Formula: C27H28N4O2S MolecularWeight: 472.60182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3N2CC(=O)NCCC4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3N2CC(=O)NCCC4=CC=CC=C4)C

InChI

InChI=1S/C27H28N4O2S/c1-19-12-13-22(16-20(19)2)29-26(33)18-34-27-30-23-10-6-7-11-24(23)31(27)17-25(32)28-15-14-21-8-4-3-5-9-21/h3-13,16H,14-15,17-18H2,1-2H3,(H,28,32)(H,29,33)