2-chloranyl-N-[[5-chloranyl-2-[4-(phenylcarbonyl)piperazin-1-yl]phenyl]carbamothioyl]benzamide

Systemtic Name: 2-chloranyl-N-[[5-chloranyl-2-[4-(phenylcarbonyl)piperazin-1-yl]phenyl]carbamothioyl]benzamide Openeye Name: N-[[2-(4-benzoylpiperazin-1-yl)-5-chloro-phenyl]carbamothioyl]-2-chloro-benzamide CAS Name: N-[[2-(4-benzoyl-1-piperazinyl)-5-chloroanilino]-sulfanylidenemethyl]-2-chlorobenzamide IUPAC Name: N-[[2-(4-benzoylpiperazin-1-yl)-5-chlorophenyl]carbamothioyl]-2-chlorobenzamide Traditional Name: N-[[2-(4-benzoylpiperazino)-5-chloro-phenyl]thiocarbamoyl]-2-chloro-benzamide Formula: C25H22Cl2N4O2S MolecularWeight: 513.43878

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C(C=C2)Cl)NC(=S)NC(=O)C3=CC=CC=C3Cl)C(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=C(C=C(C=C2)Cl)NC(=S)NC(=O)C3=CC=CC=C3Cl)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C25H22Cl2N4O2S/c26-18-10-11-22(30-12-14-31(15-13-30)24(33)17-6-2-1-3-7-17)21(16-18)28-25(34)29-23(32)19-8-4-5-9-20(19)27/h1-11,16H,12-15H2,(H2,28,29,32,34)