2-[2-[2,5-bis(oxidanylidene)-3-(phenylmethyl)piperazin-1-yl]ethanoylamino]-N-[(3,4-dimethoxyphenyl)methyl]-3-(1H-indol-3-yl)propanamide

Systemtic Name: 2-[2-[2,5-bis(oxidanylidene)-3-(phenylmethyl)piperazin-1-yl]ethanoylamino]-N-[(3,4-dimethoxyphenyl)methyl]-3-(1H-indol-3-yl)propanamide Openeye Name: 2-[[2-(3-benzyl-2,5-dioxo-piperazin-1-yl)acetyl]amino]-N-[(3,4-dimethoxyphenyl)methyl]-3-(1H-indol-3-yl)propanamide CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-2-[[2-[2,5-dioxo-3-(phenylmethyl)-1-piperazinyl]-1-oxoethyl]amino]-3-(1H-indol-3-yl)propanamide IUPAC Name: 2-[[2-(3-benzyl-2,5-dioxopiperazin-1-yl)acetyl]amino]-N-[(3,4-dimethoxyphenyl)methyl]-3-(1H-indol-3-yl)propanamide Traditional Name: 2-[[2-(3-benzyl-2,5-diketo-piperazino)acetyl]amino]-3-(1H-indol-3-yl)-N-veratryl-propionamide Formula: C33H35N5O6 MolecularWeight: 597.6609

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)C(CC2=CNC3=CC=CC=C32)NC(=O)CN4CC(=O)NC(C4=O)CC5=CC=CC=C5)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)C(CC2=CNC3=CC=CC=C32)NC(=O)CN4CC(=O)NC(C4=O)CC5=CC=CC=C5)OC

InChI

InChI=1S/C33H35N5O6/c1-43-28-13-12-22(15-29(28)44-2)17-35-32(41)26(16-23-18-34-25-11-7-6-10-24(23)25)36-30(39)19-38-20-31(40)37-27(33(38)42)14-21-8-4-3-5-9-21/h3-13,15,18,26-27,34H,14,16-17,19-20H2,1-2H3,(H,35,41)(H,36,39)(H,37,40)