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

Systemtic Name: 2-[2-[3-cyclohexyl-2,5-bis(oxidanylidene)piperazin-1-yl]ethanoylamino]-3-(1H-indol-3-yl)-N-methyl-N-[(3,4,5-triethoxyphenyl)methyl]propanamide Openeye Name: 2-[[2-(3-cyclohexyl-2,5-dioxo-piperazin-1-yl)acetyl]amino]-3-(1H-indol-3-yl)-N-methyl-N-[(3,4,5-triethoxyphenyl)methyl]propanamide CAS Name: 2-[[2-(3-cyclohexyl-2,5-dioxo-1-piperazinyl)-1-oxoethyl]amino]-3-(1H-indol-3-yl)-N-methyl-N-[(3,4,5-triethoxyphenyl)methyl]propanamide IUPAC Name: 2-[[2-(3-cyclohexyl-2,5-dioxopiperazin-1-yl)acetyl]amino]-3-(1H-indol-3-yl)-N-methyl-N-[(3,4,5-triethoxyphenyl)methyl]propanamide Traditional Name: 2-[[2-(3-cyclohexyl-2,5-diketo-piperazino)acetyl]amino]-3-(1H-indol-3-yl)-N-methyl-N-(3,4,5-triethoxybenzyl)propionamide Formula: C37H49N5O7 MolecularWeight: 675.81426

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)CN(C)C(=O)C(CC2=CNC3=CC=CC=C32)NC(=O)CN4CC(=O)NC(C4=O)C5CCCCC5

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)CN(C)C(=O)C(CC2=CNC3=CC=CC=C32)NC(=O)CN4CC(=O)NC(C4=O)C5CCCCC5

InChI

InChI=1S/C37H49N5O7/c1-5-47-30-17-24(18-31(48-6-2)35(30)49-7-3)21-41(4)36(45)29(19-26-20-38-28-16-12-11-15-27(26)28)39-32(43)22-42-23-33(44)40-34(37(42)46)25-13-9-8-10-14-25/h11-12,15-18,20,25,29,34,38H,5-10,13-14,19,21-23H2,1-4H3,(H,39,43)(H,40,44)