N-(4-azanylcyclohexyl)-1-(6-chloranylpyridin-3-yl)carbonyl-3-(4-fluorophenyl)carbonyl-1,3-diazinane-2-carboxamide

Systemtic Name: N-(4-azanylcyclohexyl)-1-(6-chloranylpyridin-3-yl)carbonyl-3-(4-fluorophenyl)carbonyl-1,3-diazinane-2-carboxamide Openeye Name: N-(4-aminocyclohexyl)-1-(6-chloropyridine-3-carbonyl)-3-(4-fluorobenzoyl)hexahydropyrimidine-2-carboxamide CAS Name: N-(4-aminocyclohexyl)-1-[(6-chloro-3-pyridinyl)-oxomethyl]-3-[(4-fluorophenyl)-oxomethyl]-1,3-diazinane-2-carboxamide IUPAC Name: N-(4-aminocyclohexyl)-1-(6-chloropyridine-3-carbonyl)-3-(4-fluorobenzoyl)-1,3-diazinane-2-carboxamide Traditional Name: N-(4-aminocyclohexyl)-1-(6-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=CN=C(C=C2)Cl)C(=O)NC3CCC(CC3)N)C(=O)C4=CC=C(C=C4)F

Isomeric SMILES

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

InChI

InChI=1S/C24H27ClFN5O3/c25-20-11-4-16(14-28-20)24(34)31-13-1-12-30(23(33)15-2-5-17(26)6-3-15)22(31)21(32)29-19-9-7-18(27)8-10-19/h2-6,11,14,18-19,22H,1,7-10,12-13,27H2,(H,29,32)