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

Systemtic Name: N2-(4-azanylcyclohexyl)-3-(4-fluorophenyl)carbonyl-N1-(3-methoxyphenyl)-1,3-diazinane-1,2-dicarboxamide Openeye Name: N2-(4-aminocyclohexyl)-3-(4-fluorobenzoyl)-N1-(3-methoxyphenyl)hexahydropyrimidine-1,2-dicarboxamide CAS Name: N2-(4-aminocyclohexyl)-3-[(4-fluorophenyl)-oxomethyl]-N1-(3-methoxyphenyl)-1,3-diazinane-1,2-dicarboxamide IUPAC Name: 2-N-(4-aminocyclohexyl)-3-(4-fluorobenzoyl)-1-N-(3-methoxyphenyl)-1,3-diazinane-1,2-dicarboxamide Traditional Name: N'-(4-aminocyclohexyl)-3-(4-fluorobenzoyl)-N-(3-methoxyphenyl)hexahydropyrimidine-1,2-dicarboxamide Formula: C26H32FN5O4 MolecularWeight: 497.561783

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H32FN5O4/c1-36-22-5-2-4-21(16-22)30-26(35)32-15-3-14-31(25(34)17-6-8-18(27)9-7-17)24(32)23(33)29-20-12-10-19(28)11-13-20/h2,4-9,16,19-20,24H,3,10-15,28H2,1H3,(H,29,33)(H,30,35)