3-chloranyl-N-[[2-[4-(diphenylmethyl)piperazin-1-yl]carbonylphenyl]carbamothioyl]benzamide

Systemtic Name: 3-chloranyl-N-[[2-[4-(diphenylmethyl)piperazin-1-yl]carbonylphenyl]carbamothioyl]benzamide Openeye Name: N-[[2-(4-benzhydrylpiperazine-1-carbonyl)phenyl]carbamothioyl]-3-chloro-benzamide CAS Name: 3-chloro-N-[[2-[[4-(diphenylmethyl)-1-piperazinyl]-oxomethyl]anilino]-sulfanylidenemethyl]benzamide IUPAC Name: N-[[2-(4-benzhydrylpiperazine-1-carbonyl)phenyl]carbamothioyl]-3-chlorobenzamide Traditional Name: N-[[2-(4-benzhydrylpiperazine-1-carbonyl)phenyl]thiocarbamoyl]-3-chloro-benzamide Formula: C32H29ClN4O2S MolecularWeight: 569.11626

Click to see the large picture

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)C5=CC(=CC=C5)Cl

Isomeric SMILES

C1CN(CCN1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)C4=CC=CC=C4NC(=S)NC(=O)C5=CC(=CC=C5)Cl

InChI

InChI=1S/C32H29ClN4O2S/c33-26-15-9-14-25(22-26)30(38)35-32(40)34-28-17-8-7-16-27(28)31(39)37-20-18-36(19-21-37)29(23-10-3-1-4-11-23)24-12-5-2-6-13-24/h1-17,22,29H,18-21H2,(H2,34,35,38,40)