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

Systemtic Name: 2-[2-[3-cyclohexyl-2,5-bis(oxidanylidene)piperazin-1-yl]ethanoylamino]-N-[(3,4-dichlorophenyl)methyl]-3-(1H-indol-3-yl)-N-methyl-propanamide Openeye Name: 2-[[2-(3-cyclohexyl-2,5-dioxo-piperazin-1-yl)acetyl]amino]-N-[(3,4-dichlorophenyl)methyl]-3-(1H-indol-3-yl)-N-methyl-propanamide CAS Name: 2-[[2-(3-cyclohexyl-2,5-dioxo-1-piperazinyl)-1-oxoethyl]amino]-N-[(3,4-dichlorophenyl)methyl]-3-(1H-indol-3-yl)-N-methylpropanamide IUPAC Name: 2-[[2-(3-cyclohexyl-2,5-dioxopiperazin-1-yl)acetyl]amino]-N-[(3,4-dichlorophenyl)methyl]-3-(1H-indol-3-yl)-N-methylpropanamide Traditional Name: 2-[[2-(3-cyclohexyl-2,5-diketo-piperazino)acetyl]amino]-N-(3,4-dichlorobenzyl)-3-(1H-indol-3-yl)-N-methyl-propionamide Formula: C31H35Cl2N5O4 MolecularWeight: 612.5467

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H35Cl2N5O4/c1-37(16-19-11-12-23(32)24(33)13-19)30(41)26(14-21-15-34-25-10-6-5-9-22(21)25)35-27(39)17-38-18-28(40)36-29(31(38)42)20-7-3-2-4-8-20/h5-6,9-13,15,20,26,29,34H,2-4,7-8,14,16-18H2,1H3,(H,35,39)(H,36,40)