(E)-N-[[2-[4-(diphenylmethyl)piperazin-1-yl]carbonylphenyl]carbamothioyl]-3-naphthalen-1-yl-prop-2-enamide

Systemtic Name: (E)-N-[[2-[4-(diphenylmethyl)piperazin-1-yl]carbonylphenyl]carbamothioyl]-3-naphthalen-1-yl-prop-2-enamide Openeye Name: (E)-N-[[2-(4-benzhydrylpiperazine-1-carbonyl)phenyl]carbamothioyl]-3-(1-naphthyl)prop-2-enamide CAS Name: (E)-N-[[2-[[4-(diphenylmethyl)-1-piperazinyl]-oxomethyl]anilino]-sulfanylidenemethyl]-3-(1-naphthalenyl)-2-propenamide IUPAC Name: (E)-N-[[2-(4-benzhydrylpiperazine-1-carbonyl)phenyl]carbamothioyl]-3-naphthalen-1-ylprop-2-enamide Traditional Name: (E)-N-[[2-(4-benzhydrylpiperazine-1-carbonyl)phenyl]thiocarbamoyl]-3-(1-naphthyl)acrylamide Formula: C38H34N4O2S MolecularWeight: 610.76716

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)C4=CC=CC=C4NC(=S)NC(=O)C=CC5=CC=CC6=CC=CC=C65

Isomeric SMILES

C1CN(CCN1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)C4=CC=CC=C4NC(=S)NC(=O)/C=C/C5=CC=CC6=CC=CC=C65

InChI

InChI=1S/C38H34N4O2S/c43-35(23-22-29-18-11-17-28-12-7-8-19-32(28)29)40-38(45)39-34-21-10-9-20-33(34)37(44)42-26-24-41(25-27-42)36(30-13-3-1-4-14-30)31-15-5-2-6-16-31/h1-23,36H,24-27H2,(H2,39,40,43,45)/b23-22+