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

Systemtic Name: 2-[2-(4-cyclohexylpiperazin-1-yl)ethanoylamino]-N-[(3,4-diethoxyphenyl)methyl]-N-ethanoyl-3-(1H-indol-3-yl)propanamide Openeye Name: N-acetyl-2-[[2-(4-cyclohexylpiperazin-1-yl)acetyl]amino]-N-[(3,4-diethoxyphenyl)methyl]-3-(1H-indol-3-yl)propanamide CAS Name: N-acetyl-2-[[2-(4-cyclohexyl-1-piperazinyl)-1-oxoethyl]amino]-N-[(3,4-diethoxyphenyl)methyl]-3-(1H-indol-3-yl)propanamide IUPAC Name: N-acetyl-2-[[2-(4-cyclohexylpiperazin-1-yl)acetyl]amino]-N-[(3,4-diethoxyphenyl)methyl]-3-(1H-indol-3-yl)propanamide Traditional Name: N-acetyl-2-[[2-(4-cyclohexylpiperazino)acetyl]amino]-N-(3,4-diethoxybenzyl)-3-(1H-indol-3-yl)propionamide Formula: C36H49N5O5 MolecularWeight: 631.80476

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CN(C(=O)C)C(=O)C(CC2=CNC3=CC=CC=C32)NC(=O)CN4CCN(CC4)C5CCCCC5)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CN(C(=O)C)C(=O)C(CC2=CNC3=CC=CC=C32)NC(=O)CN4CCN(CC4)C5CCCCC5)OCC

InChI

InChI=1S/C36H49N5O5/c1-4-45-33-16-15-27(21-34(33)46-5-2)24-41(26(3)42)36(44)32(22-28-23-37-31-14-10-9-13-30(28)31)38-35(43)25-39-17-19-40(20-18-39)29-11-7-6-8-12-29/h9-10,13-16,21,23,29,32,37H,4-8,11-12,17-20,22,24-25H2,1-3H3,(H,38,43)