N2-(4-azanylcyclohexyl)-3-(2-chloranylpyridin-3-yl)carbonyl-N1-(4-methoxyphenyl)-1,3-diazinane-1,2-dicarboxamide

Systemtic Name: N2-(4-azanylcyclohexyl)-3-(2-chloranylpyridin-3-yl)carbonyl-N1-(4-methoxyphenyl)-1,3-diazinane-1,2-dicarboxamide Openeye Name: N2-(4-aminocyclohexyl)-3-(2-chloropyridine-3-carbonyl)-N1-(4-methoxyphenyl)hexahydropyrimidine-1,2-dicarboxamide CAS Name: N2-(4-aminocyclohexyl)-3-[(2-chloro-3-pyridinyl)-oxomethyl]-N1-(4-methoxyphenyl)-1,3-diazinane-1,2-dicarboxamide IUPAC Name: 2-N-(4-aminocyclohexyl)-3-(2-chloropyridine-3-carbonyl)-1-N-(4-methoxyphenyl)-1,3-diazinane-1,2-dicarboxamide Traditional Name: N'-(4-aminocyclohexyl)-3-(2-chloronicotinoyl)-N-(4-methoxyphenyl)hexahydropyrimidine-1,2-dicarboxamide Formula: C25H31ClN6O4 MolecularWeight: 515.00444

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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=C(N=CC=C4)Cl

Isomeric SMILES

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

InChI

InChI=1S/C25H31ClN6O4/c1-36-19-11-9-18(10-12-19)30-25(35)32-15-3-14-31(24(34)20-4-2-13-28-21(20)26)23(32)22(33)29-17-7-5-16(27)6-8-17/h2,4,9-13,16-17,23H,3,5-8,14-15,27H2,1H3,(H,29,33)(H,30,35)