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

Systemtic Name: N2-(4-azanylcyclohexyl)-N1-(4-methoxyphenyl)-3-pyridin-3-ylcarbonyl-1,3-diazinane-1,2-dicarboxamide Openeye Name: N2-(4-aminocyclohexyl)-N1-(4-methoxyphenyl)-3-(pyridine-3-carbonyl)hexahydropyrimidine-1,2-dicarboxamide CAS Name: N2-(4-aminocyclohexyl)-N1-(4-methoxyphenyl)-3-[oxo(3-pyridinyl)methyl]-1,3-diazinane-1,2-dicarboxamide IUPAC Name: 2-N-(4-aminocyclohexyl)-1-N-(4-methoxyphenyl)-3-(pyridine-3-carbonyl)-1,3-diazinane-1,2-dicarboxamide Traditional Name: N'-(4-aminocyclohexyl)-N-(4-methoxyphenyl)-3-nicotinoyl-hexahydropyrimidine-1,2-dicarboxamide Formula: C25H32N6O4 MolecularWeight: 480.55938

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)N2CCCN(C2C(=O)NC3CCC(CC3)N)C(=O)C4=CN=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)N2CCCN(C2C(=O)NC3CCC(CC3)N)C(=O)C4=CN=CC=C4

InChI

InChI=1S/C25H32N6O4/c1-35-21-11-9-20(10-12-21)29-25(34)31-15-3-14-30(24(33)17-4-2-13-27-16-17)23(31)22(32)28-19-7-5-18(26)6-8-19/h2,4,9-13,16,18-19,23H,3,5-8,14-15,26H2,1H3,(H,28,32)(H,29,34)