N-(2-azanylcyclohexyl)-3-[(3,4-dimethoxyphenyl)carbonylamino]-4-[(4-pyridin-2-ylpiperazin-1-yl)methyl]benzamide

Systemtic Name: N-(2-azanylcyclohexyl)-3-[(3,4-dimethoxyphenyl)carbonylamino]-4-[(4-pyridin-2-ylpiperazin-1-yl)methyl]benzamide Openeye Name: N-(2-aminocyclohexyl)-3-[(3,4-dimethoxybenzoyl)amino]-4-[[4-(2-pyridyl)piperazin-1-yl]methyl]benzamide CAS Name: N-(2-aminocyclohexyl)-3-[[(3,4-dimethoxyphenyl)-oxomethyl]amino]-4-[[4-(2-pyridinyl)-1-piperazinyl]methyl]benzamide IUPAC Name: N-(2-aminocyclohexyl)-3-[(3,4-dimethoxybenzoyl)amino]-4-[(4-pyridin-2-ylpiperazin-1-yl)methyl]benzamide Traditional Name: N-(2-aminocyclohexyl)-4-[[4-(2-pyridyl)piperazino]methyl]-3-(veratroylamino)benzamide Formula: C32H40N6O4 MolecularWeight: 572.6978

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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)NC3CCCCC3N)CN4CCN(CC4)C5=CC=CC=N5)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=C(C=CC(=C2)C(=O)NC3CCCCC3N)CN4CCN(CC4)C5=CC=CC=N5)OC

InChI

InChI=1S/C32H40N6O4/c1-41-28-13-12-23(20-29(28)42-2)32(40)36-27-19-22(31(39)35-26-8-4-3-7-25(26)33)10-11-24(27)21-37-15-17-38(18-16-37)30-9-5-6-14-34-30/h5-6,9-14,19-20,25-26H,3-4,7-8,15-18,21,33H2,1-2H3,(H,35,39)(H,36,40)