N2-(4-azanylcyclohexyl)-3-(5-bromanylpyridin-3-yl)carbonyl-N1-(3-fluorophenyl)-1,3-diazinane-1,2-dicarboxamide

Systemtic Name: N2-(4-azanylcyclohexyl)-3-(5-bromanylpyridin-3-yl)carbonyl-N1-(3-fluorophenyl)-1,3-diazinane-1,2-dicarboxamide Openeye Name: N2-(4-aminocyclohexyl)-3-(5-bromopyridine-3-carbonyl)-N1-(3-fluorophenyl)hexahydropyrimidine-1,2-dicarboxamide CAS Name: N2-(4-aminocyclohexyl)-3-[(5-bromo-3-pyridinyl)-oxomethyl]-N1-(3-fluorophenyl)-1,3-diazinane-1,2-dicarboxamide IUPAC Name: 2-N-(4-aminocyclohexyl)-3-(5-bromopyridine-3-carbonyl)-1-N-(3-fluorophenyl)-1,3-diazinane-1,2-dicarboxamide Traditional Name: N'-(4-aminocyclohexyl)-3-(5-bromonicotinoyl)-N-(3-fluorophenyl)hexahydropyrimidine-1,2-dicarboxamide Formula: C24H28BrFN6O3 MolecularWeight: 547.419923

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(N(C1)C(=O)NC2=CC(=CC=C2)F)C(=O)NC3CCC(CC3)N)C(=O)C4=CC(=CN=C4)Br

Isomeric SMILES

C1CN(C(N(C1)C(=O)NC2=CC(=CC=C2)F)C(=O)NC3CCC(CC3)N)C(=O)C4=CC(=CN=C4)Br

InChI

InChI=1S/C24H28BrFN6O3/c25-16-11-15(13-28-14-16)23(34)31-9-2-10-32(24(35)30-20-4-1-3-17(26)12-20)22(31)21(33)29-19-7-5-18(27)6-8-19/h1,3-4,11-14,18-19,22H,2,5-10,27H2,(H,29,33)(H,30,35)