2-[2-[2,5-bis(oxidanylidene)-3-(phenylmethyl)piperazin-1-yl]ethanoylamino]-N-[(2-chlorophenyl)methyl]-3-(1H-indol-3-yl)-N-methyl-propanamide

Systemtic Name: 2-[2-[2,5-bis(oxidanylidene)-3-(phenylmethyl)piperazin-1-yl]ethanoylamino]-N-[(2-chlorophenyl)methyl]-3-(1H-indol-3-yl)-N-methyl-propanamide Openeye Name: 2-[[2-(3-benzyl-2,5-dioxo-piperazin-1-yl)acetyl]amino]-N-[(2-chlorophenyl)methyl]-3-(1H-indol-3-yl)-N-methyl-propanamide CAS Name: N-[(2-chlorophenyl)methyl]-2-[[2-[2,5-dioxo-3-(phenylmethyl)-1-piperazinyl]-1-oxoethyl]amino]-3-(1H-indol-3-yl)-N-methylpropanamide IUPAC Name: 2-[[2-(3-benzyl-2,5-dioxopiperazin-1-yl)acetyl]amino]-N-[(2-chlorophenyl)methyl]-3-(1H-indol-3-yl)-N-methylpropanamide Traditional Name: 2-[[2-(3-benzyl-2,5-diketo-piperazino)acetyl]amino]-N-(2-chlorobenzyl)-3-(1H-indol-3-yl)-N-methyl-propionamide Formula: C32H32ClN5O4 MolecularWeight: 586.08058

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1Cl)C(=O)C(CC2=CNC3=CC=CC=C32)NC(=O)CN4CC(=O)NC(C4=O)CC5=CC=CC=C5

Isomeric SMILES

CN(CC1=CC=CC=C1Cl)C(=O)C(CC2=CNC3=CC=CC=C32)NC(=O)CN4CC(=O)NC(C4=O)CC5=CC=CC=C5

InChI

InChI=1S/C32H32ClN5O4/c1-37(18-22-11-5-7-13-25(22)33)31(41)28(16-23-17-34-26-14-8-6-12-24(23)26)36-30(40)20-38-19-29(39)35-27(32(38)42)15-21-9-3-2-4-10-21/h2-14,17,27-28,34H,15-16,18-20H2,1H3,(H,35,39)(H,36,40)