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

Systemtic Name: 2-[2-(4-cyclohexylpiperazin-1-yl)ethanoylamino]-N-ethanoyl-3-(1H-indol-3-yl)-N-[(2-methylphenyl)methyl]propanamide Openeye Name: N-acetyl-2-[[2-(4-cyclohexylpiperazin-1-yl)acetyl]amino]-3-(1H-indol-3-yl)-N-(o-tolylmethyl)propanamide CAS Name: N-acetyl-2-[[2-(4-cyclohexyl-1-piperazinyl)-1-oxoethyl]amino]-3-(1H-indol-3-yl)-N-[(2-methylphenyl)methyl]propanamide IUPAC Name: N-acetyl-2-[[2-(4-cyclohexylpiperazin-1-yl)acetyl]amino]-3-(1H-indol-3-yl)-N-[(2-methylphenyl)methyl]propanamide Traditional Name: N-acetyl-2-[[2-(4-cyclohexylpiperazino)acetyl]amino]-3-(1H-indol-3-yl)-N-(2-methylbenzyl)propionamide Formula: C33H43N5O3 MolecularWeight: 557.72622

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C33H43N5O3/c1-24-10-6-7-11-26(24)22-38(25(2)39)33(41)31(20-27-21-34-30-15-9-8-14-29(27)30)35-32(40)23-36-16-18-37(19-17-36)28-12-4-3-5-13-28/h6-11,14-15,21,28,31,34H,3-5,12-13,16-20,22-23H2,1-2H3,(H,35,40)