N-(4-azanylcyclohexyl)-1-(2-chloranylpyridin-3-yl)carbonyl-3-(4-fluorophenyl)carbonyl-1,3-diazinane-2-carboxamide

Systemtic Name: N-(4-azanylcyclohexyl)-1-(2-chloranylpyridin-3-yl)carbonyl-3-(4-fluorophenyl)carbonyl-1,3-diazinane-2-carboxamide Openeye Name: N-(4-aminocyclohexyl)-1-(2-chloropyridine-3-carbonyl)-3-(4-fluorobenzoyl)hexahydropyrimidine-2-carboxamide CAS Name: N-(4-aminocyclohexyl)-1-[(2-chloro-3-pyridinyl)-oxomethyl]-3-[(4-fluorophenyl)-oxomethyl]-1,3-diazinane-2-carboxamide IUPAC Name: N-(4-aminocyclohexyl)-1-(2-chloropyridine-3-carbonyl)-3-(4-fluorobenzoyl)-1,3-diazinane-2-carboxamide Traditional Name: N-(4-aminocyclohexyl)-1-(2-chloronicotinoyl)-3-(4-fluorobenzoyl)hexahydropyrimidine-2-carboxamide Formula: C24H27ClFN5O3 MolecularWeight: 487.954283

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(N(C1)C(=O)C2=C(N=CC=C2)Cl)C(=O)NC3CCC(CC3)N)C(=O)C4=CC=C(C=C4)F

Isomeric SMILES

C1CN(C(N(C1)C(=O)C2=C(N=CC=C2)Cl)C(=O)NC3CCC(CC3)N)C(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C24H27ClFN5O3/c25-20-19(3-1-12-28-20)24(34)31-14-2-13-30(23(33)15-4-6-16(26)7-5-15)22(31)21(32)29-18-10-8-17(27)9-11-18/h1,3-7,12,17-18,22H,2,8-11,13-14,27H2,(H,29,32)