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

Systemtic Name: 2-[2-(4-cyclohexylpiperazin-1-yl)ethanoylamino]-3-(1H-indol-3-yl)-N-methyl-N-[(2-methylphenyl)methyl]propanamide Openeye Name: 2-[[2-(4-cyclohexylpiperazin-1-yl)acetyl]amino]-3-(1H-indol-3-yl)-N-methyl-N-(o-tolylmethyl)propanamide CAS Name: 2-[[2-(4-cyclohexyl-1-piperazinyl)-1-oxoethyl]amino]-3-(1H-indol-3-yl)-N-methyl-N-[(2-methylphenyl)methyl]propanamide IUPAC Name: 2-[[2-(4-cyclohexylpiperazin-1-yl)acetyl]amino]-3-(1H-indol-3-yl)-N-methyl-N-[(2-methylphenyl)methyl]propanamide Traditional Name: 2-[[2-(4-cyclohexylpiperazino)acetyl]amino]-3-(1H-indol-3-yl)-N-methyl-N-(2-methylbenzyl)propionamide Formula: C32H43N5O2 MolecularWeight: 529.71612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN(C)C(=O)C(CC2=CNC3=CC=CC=C32)NC(=O)CN4CCN(CC4)C5CCCCC5

Isomeric SMILES

CC1=CC=CC=C1CN(C)C(=O)C(CC2=CNC3=CC=CC=C32)NC(=O)CN4CCN(CC4)C5CCCCC5

InChI

InChI=1S/C32H43N5O2/c1-24-10-6-7-11-25(24)22-35(2)32(39)30(20-26-21-33-29-15-9-8-14-28(26)29)34-31(38)23-36-16-18-37(19-17-36)27-12-4-3-5-13-27/h6-11,14-15,21,27,30,33H,3-5,12-13,16-20,22-23H2,1-2H3,(H,34,38)