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

Systemtic Name: 2-[2-[3-cyclohexyl-2,5-bis(oxidanylidene)piperazin-1-yl]ethanoylamino]-N-[(3,4-dimethylphenyl)methyl]-3-(1H-indol-3-yl)propanamide Openeye Name: 2-[[2-(3-cyclohexyl-2,5-dioxo-piperazin-1-yl)acetyl]amino]-N-[(3,4-dimethylphenyl)methyl]-3-(1H-indol-3-yl)propanamide CAS Name: 2-[[2-(3-cyclohexyl-2,5-dioxo-1-piperazinyl)-1-oxoethyl]amino]-N-[(3,4-dimethylphenyl)methyl]-3-(1H-indol-3-yl)propanamide IUPAC Name: 2-[[2-(3-cyclohexyl-2,5-dioxopiperazin-1-yl)acetyl]amino]-N-[(3,4-dimethylphenyl)methyl]-3-(1H-indol-3-yl)propanamide Traditional Name: 2-[[2-(3-cyclohexyl-2,5-diketo-piperazino)acetyl]amino]-N-(3,4-dimethylbenzyl)-3-(1H-indol-3-yl)propionamide Formula: C32H39N5O4 MolecularWeight: 557.68316

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CNC(=O)C(CC2=CNC3=CC=CC=C32)NC(=O)CN4CC(=O)NC(C4=O)C5CCCCC5)C

Isomeric SMILES

CC1=C(C=C(C=C1)CNC(=O)C(CC2=CNC3=CC=CC=C32)NC(=O)CN4CC(=O)NC(C4=O)C5CCCCC5)C

InChI

InChI=1S/C32H39N5O4/c1-20-12-13-22(14-21(20)2)16-34-31(40)27(15-24-17-33-26-11-7-6-10-25(24)26)35-28(38)18-37-19-29(39)36-30(32(37)41)23-8-4-3-5-9-23/h6-7,10-14,17,23,27,30,33H,3-5,8-9,15-16,18-19H2,1-2H3,(H,34,40)(H,35,38)(H,36,39)