2-[2-(4-cyclohexylpiperazin-1-yl)ethanoylamino]-N-ethanoyl-3-(1H-indol-3-yl)-N-[(3,4,5-trimethylphenyl)methyl]propanamide

Systemtic Name: 2-[2-(4-cyclohexylpiperazin-1-yl)ethanoylamino]-N-ethanoyl-3-(1H-indol-3-yl)-N-[(3,4,5-trimethylphenyl)methyl]propanamide Openeye Name: N-acetyl-2-[[2-(4-cyclohexylpiperazin-1-yl)acetyl]amino]-3-(1H-indol-3-yl)-N-[(3,4,5-trimethylphenyl)methyl]propanamide CAS Name: N-acetyl-2-[[2-(4-cyclohexyl-1-piperazinyl)-1-oxoethyl]amino]-3-(1H-indol-3-yl)-N-[(3,4,5-trimethylphenyl)methyl]propanamide IUPAC Name: N-acetyl-2-[[2-(4-cyclohexylpiperazin-1-yl)acetyl]amino]-3-(1H-indol-3-yl)-N-[(3,4,5-trimethylphenyl)methyl]propanamide Traditional Name: N-acetyl-2-[[2-(4-cyclohexylpiperazino)acetyl]amino]-3-(1H-indol-3-yl)-N-(3,4,5-trimethylbenzyl)propionamide Formula: C35H47N5O3 MolecularWeight: 585.77938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C)C)CN(C(=O)C)C(=O)C(CC2=CNC3=CC=CC=C32)NC(=O)CN4CCN(CC4)C5CCCCC5

Isomeric SMILES

CC1=CC(=CC(=C1C)C)CN(C(=O)C)C(=O)C(CC2=CNC3=CC=CC=C32)NC(=O)CN4CCN(CC4)C5CCCCC5

InChI

InChI=1S/C35H47N5O3/c1-24-18-28(19-25(2)26(24)3)22-40(27(4)41)35(43)33(20-29-21-36-32-13-9-8-12-31(29)32)37-34(42)23-38-14-16-39(17-15-38)30-10-6-5-7-11-30/h8-9,12-13,18-19,21,30,33,36H,5-7,10-11,14-17,20,22-23H2,1-4H3,(H,37,42)