2-[2-(4-cyclohexylpiperazin-1-yl)ethanoylamino]-3-(1H-indol-3-yl)-N-[(2-methylphenyl)methyl]propanamide

Systemtic Name: 2-[2-(4-cyclohexylpiperazin-1-yl)ethanoylamino]-3-(1H-indol-3-yl)-N-[(2-methylphenyl)methyl]propanamide Openeye Name: 2-[[2-(4-cyclohexylpiperazin-1-yl)acetyl]amino]-3-(1H-indol-3-yl)-N-(o-tolylmethyl)propanamide CAS Name: 2-[[2-(4-cyclohexyl-1-piperazinyl)-1-oxoethyl]amino]-3-(1H-indol-3-yl)-N-[(2-methylphenyl)methyl]propanamide IUPAC Name: 2-[[2-(4-cyclohexylpiperazin-1-yl)acetyl]amino]-3-(1H-indol-3-yl)-N-[(2-methylphenyl)methyl]propanamide Traditional Name: 2-[[2-(4-cyclohexylpiperazino)acetyl]amino]-3-(1H-indol-3-yl)-N-(2-methylbenzyl)propionamide Formula: C31H41N5O2 MolecularWeight: 515.68954

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CNC(=O)C(CC2=CNC3=CC=CC=C32)NC(=O)CN4CCN(CC4)C5CCCCC5

Isomeric SMILES

CC1=CC=CC=C1CNC(=O)C(CC2=CNC3=CC=CC=C32)NC(=O)CN4CCN(CC4)C5CCCCC5

InChI

InChI=1S/C31H41N5O2/c1-23-9-5-6-10-24(23)20-33-31(38)29(19-25-21-32-28-14-8-7-13-27(25)28)34-30(37)22-35-15-17-36(18-16-35)26-11-3-2-4-12-26/h5-10,13-14,21,26,29,32H,2-4,11-12,15-20,22H2,1H3,(H,33,38)(H,34,37)