N2-(4-azanylcyclohexyl)-N1-(3-methylphenyl)-3-pyridin-3-ylcarbonyl-1,3-diazinane-1,2-dicarboxamide

Systemtic Name: N2-(4-azanylcyclohexyl)-N1-(3-methylphenyl)-3-pyridin-3-ylcarbonyl-1,3-diazinane-1,2-dicarboxamide Openeye Name: N2-(4-aminocyclohexyl)-N1-(m-tolyl)-3-(pyridine-3-carbonyl)hexahydropyrimidine-1,2-dicarboxamide CAS Name: N2-(4-aminocyclohexyl)-N1-(3-methylphenyl)-3-[oxo(3-pyridinyl)methyl]-1,3-diazinane-1,2-dicarboxamide IUPAC Name: 2-N-(4-aminocyclohexyl)-1-N-(3-methylphenyl)-3-(pyridine-3-carbonyl)-1,3-diazinane-1,2-dicarboxamide Traditional Name: N'-(4-aminocyclohexyl)-N-(m-tolyl)-3-nicotinoyl-hexahydropyrimidine-1,2-dicarboxamide Formula: C25H32N6O3 MolecularWeight: 464.55998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)N2CCCN(C2C(=O)NC3CCC(CC3)N)C(=O)C4=CN=CC=C4

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)N2CCCN(C2C(=O)NC3CCC(CC3)N)C(=O)C4=CN=CC=C4

InChI

InChI=1S/C25H32N6O3/c1-17-5-2-7-21(15-17)29-25(34)31-14-4-13-30(24(33)18-6-3-12-27-16-18)23(31)22(32)28-20-10-8-19(26)9-11-20/h2-3,5-7,12,15-16,19-20,23H,4,8-11,13-14,26H2,1H3,(H,28,32)(H,29,34)