N-[1-(1H-benzimidazol-2-yl)-2-phenyl-ethyl]-2-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-propanamide

Systemtic Name: N-[1-(1H-benzimidazol-2-yl)-2-phenyl-ethyl]-2-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-propanamide Openeye Name: N-[1-(1H-benzimidazol-2-yl)-2-phenyl-ethyl]-2-[2-(4-methylanilino)-2-oxo-ethyl]sulfanyl-propanamide CAS Name: N-[1-(1H-benzimidazol-2-yl)-2-phenylethyl]-2-[[2-(4-methylanilino)-2-oxoethyl]thio]propanamide IUPAC Name: N-[1-(1H-benzimidazol-2-yl)-2-phenylethyl]-2-[2-(4-methylanilino)-2-oxoethyl]sulfanylpropanamide Traditional Name: N-[1-(1H-benzimidazol-2-yl)-2-phenyl-ethyl]-2-[[2-keto-2-(p-toluidino)ethyl]thio]propionamide Formula: C27H28N4O2S MolecularWeight: 472.60182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CSC(C)C(=O)NC(CC2=CC=CC=C2)C3=NC4=CC=CC=C4N3

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CSC(C)C(=O)NC(CC2=CC=CC=C2)C3=NC4=CC=CC=C4N3

InChI

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