N-(4-azanylcyclohexyl)-3-[(3,4-dimethoxyphenyl)carbonylamino]-4-(4-pyridin-4-ylcarbonylpiperazin-1-yl)benzamide

Systemtic Name: N-(4-azanylcyclohexyl)-3-[(3,4-dimethoxyphenyl)carbonylamino]-4-(4-pyridin-4-ylcarbonylpiperazin-1-yl)benzamide Openeye Name: N-(4-aminocyclohexyl)-3-[(3,4-dimethoxybenzoyl)amino]-4-[4-(pyridine-4-carbonyl)piperazin-1-yl]benzamide CAS Name: N-(4-aminocyclohexyl)-3-[[(3,4-dimethoxyphenyl)-oxomethyl]amino]-4-[4-[oxo(pyridin-4-yl)methyl]-1-piperazinyl]benzamide IUPAC Name: N-(4-aminocyclohexyl)-3-[(3,4-dimethoxybenzoyl)amino]-4-[4-(pyridine-4-carbonyl)piperazin-1-yl]benzamide Traditional Name: N-(4-aminocyclohexyl)-4-(4-isonicotinoylpiperazino)-3-(veratroylamino)benzamide Formula: C32H38N6O5 MolecularWeight: 586.68132

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=C(C=CC(=C2)C(=O)NC3CCC(CC3)N)N4CCN(CC4)C(=O)C5=CC=NC=C5)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=C(C=CC(=C2)C(=O)NC3CCC(CC3)N)N4CCN(CC4)C(=O)C5=CC=NC=C5)OC

InChI

InChI=1S/C32H38N6O5/c1-42-28-10-4-23(20-29(28)43-2)31(40)36-26-19-22(30(39)35-25-7-5-24(33)6-8-25)3-9-27(26)37-15-17-38(18-16-37)32(41)21-11-13-34-14-12-21/h3-4,9-14,19-20,24-25H,5-8,15-18,33H2,1-2H3,(H,35,39)(H,36,40)