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

Systemtic Name: N-[4-(benzimidazol-1-yl)phenyl]-2-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-propanamide Openeye Name: N-[4-(benzimidazol-1-yl)phenyl]-2-[2-(4-methylanilino)-2-oxo-ethyl]sulfanyl-propanamide CAS Name: N-[4-(1-benzimidazolyl)phenyl]-2-[[2-(4-methylanilino)-2-oxoethyl]thio]propanamide IUPAC Name: N-[4-(benzimidazol-1-yl)phenyl]-2-[2-(4-methylanilino)-2-oxoethyl]sulfanylpropanamide Traditional Name: N-[4-(benzimidazol-1-yl)phenyl]-2-[[2-keto-2-(p-toluidino)ethyl]thio]propionamide Formula: C25H24N4O2S MolecularWeight: 444.54866

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CSC(C)C(=O)NC2=CC=C(C=C2)N3C=NC4=CC=CC=C43

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CSC(C)C(=O)NC2=CC=C(C=C2)N3C=NC4=CC=CC=C43

InChI

InChI=1S/C25H24N4O2S/c1-17-7-9-19(10-8-17)27-24(30)15-32-18(2)25(31)28-20-11-13-21(14-12-20)29-16-26-22-5-3-4-6-23(22)29/h3-14,16,18H,15H2,1-2H3,(H,27,30)(H,28,31)