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

Systemtic Name: N-[(3,4-diethylphenyl)methyl]-3-(1H-indol-3-yl)-N-methyl-2-[2-[3-methyl-2,5-bis(oxidanylidene)piperazin-1-yl]ethanoylamino]propanamide Openeye Name: N-[(3,4-diethylphenyl)methyl]-3-(1H-indol-3-yl)-N-methyl-2-[[2-(3-methyl-2,5-dioxo-piperazin-1-yl)acetyl]amino]propanamide CAS Name: N-[(3,4-diethylphenyl)methyl]-3-(1H-indol-3-yl)-N-methyl-2-[[2-(3-methyl-2,5-dioxo-1-piperazinyl)-1-oxoethyl]amino]propanamide IUPAC Name: N-[(3,4-diethylphenyl)methyl]-3-(1H-indol-3-yl)-N-methyl-2-[[2-(3-methyl-2,5-dioxopiperazin-1-yl)acetyl]amino]propanamide Traditional Name: N-(3,4-diethylbenzyl)-2-[[2-(2,5-diketo-3-methyl-piperazino)acetyl]amino]-3-(1H-indol-3-yl)-N-methyl-propionamide Formula: C30H37N5O4 MolecularWeight: 531.64588

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)CN(C)C(=O)C(CC2=CNC3=CC=CC=C32)NC(=O)CN4CC(=O)NC(C4=O)C)CC

Isomeric SMILES

CCC1=C(C=C(C=C1)CN(C)C(=O)C(CC2=CNC3=CC=CC=C32)NC(=O)CN4CC(=O)NC(C4=O)C)CC

InChI

InChI=1S/C30H37N5O4/c1-5-21-12-11-20(13-22(21)6-2)16-34(4)30(39)26(14-23-15-31-25-10-8-7-9-24(23)25)33-28(37)18-35-17-27(36)32-19(3)29(35)38/h7-13,15,19,26,31H,5-6,14,16-18H2,1-4H3,(H,32,36)(H,33,37)