4-[2,5-bis(oxidanylidene)-3-phenyl-piperazin-1-yl]-2-(1H-indol-3-ylmethyl)-3-oxidanylidene-N-[[3,4,5-tris(chloranyl)phenyl]methyl]butanamide

Systemtic Name: 4-[2,5-bis(oxidanylidene)-3-phenyl-piperazin-1-yl]-2-(1H-indol-3-ylmethyl)-3-oxidanylidene-N-[[3,4,5-tris(chloranyl)phenyl]methyl]butanamide Openeye Name: 4-(2,5-dioxo-3-phenyl-piperazin-1-yl)-2-(1H-indol-3-ylmethyl)-3-oxo-N-[(3,4,5-trichlorophenyl)methyl]butanamide CAS Name: 4-(2,5-dioxo-3-phenyl-1-piperazinyl)-2-(1H-indol-3-ylmethyl)-3-oxo-N-[(3,4,5-trichlorophenyl)methyl]butanamide IUPAC Name: 4-(2,5-dioxo-3-phenylpiperazin-1-yl)-2-(1H-indol-3-ylmethyl)-3-oxo-N-[(3,4,5-trichlorophenyl)methyl]butanamide Traditional Name: 4-(2,5-diketo-3-phenyl-piperazino)-2-(1H-indol-3-ylmethyl)-3-keto-N-(3,4,5-trichlorobenzyl)butyramide Formula: C30H25Cl3N4O4 MolecularWeight: 611.9029

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NC(C(=O)N1CC(=O)C(CC2=CNC3=CC=CC=C32)C(=O)NCC4=CC(=C(C(=C4)Cl)Cl)Cl)C5=CC=CC=C5

Isomeric SMILES

C1C(=O)NC(C(=O)N1CC(=O)C(CC2=CNC3=CC=CC=C32)C(=O)NCC4=CC(=C(C(=C4)Cl)Cl)Cl)C5=CC=CC=C5

InChI

InChI=1S/C30H25Cl3N4O4/c31-22-10-17(11-23(32)27(22)33)13-35-29(40)21(12-19-14-34-24-9-5-4-8-20(19)24)25(38)15-37-16-26(39)36-28(30(37)41)18-6-2-1-3-7-18/h1-11,14,21,28,34H,12-13,15-16H2,(H,35,40)(H,36,39)