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

Systemtic Name: N-(4-azanylcyclohexyl)-3-[(3-methoxyphenyl)carbonylamino]-4-(4-pyridin-4-ylcarbonylpiperazin-1-yl)benzamide Openeye Name: N-(4-aminocyclohexyl)-3-[(3-methoxybenzoyl)amino]-4-[4-(pyridine-4-carbonyl)piperazin-1-yl]benzamide CAS Name: N-(4-aminocyclohexyl)-3-[[(3-methoxyphenyl)-oxomethyl]amino]-4-[4-[oxo(pyridin-4-yl)methyl]-1-piperazinyl]benzamide IUPAC Name: N-(4-aminocyclohexyl)-3-[(3-methoxybenzoyl)amino]-4-[4-(pyridine-4-carbonyl)piperazin-1-yl]benzamide Traditional Name: N-(4-aminocyclohexyl)-4-(4-isonicotinoylpiperazino)-3-(m-anisoylamino)benzamide Formula: C31H36N6O4 MolecularWeight: 556.65534

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H36N6O4/c1-41-26-4-2-3-22(19-26)30(39)35-27-20-23(29(38)34-25-8-6-24(32)7-9-25)5-10-28(27)36-15-17-37(18-16-36)31(40)21-11-13-33-14-12-21/h2-5,10-14,19-20,24-25H,6-9,15-18,32H2,1H3,(H,34,38)(H,35,39)