N-(3-chloranyl-4-fluoranyl-phenyl)-4-(2,6-dimethoxypyrimidin-4-yl)piperazine-1-carboxamide

Systemtic Name: N-(3-chloranyl-4-fluoranyl-phenyl)-4-(2,6-dimethoxypyrimidin-4-yl)piperazine-1-carboxamide Openeye Name: N-(3-chloro-4-fluoro-phenyl)-4-(2,6-dimethoxypyrimidin-4-yl)piperazine-1-carboxamide CAS Name: N-(3-chloro-4-fluorophenyl)-4-(2,6-dimethoxy-4-pyrimidinyl)-1-piperazinecarboxamide IUPAC Name: N-(3-chloro-4-fluorophenyl)-4-(2,6-dimethoxypyrimidin-4-yl)piperazine-1-carboxamide Traditional Name: N-(3-chloro-4-fluoro-phenyl)-4-(2,6-dimethoxypyrimidin-4-yl)piperazine-1-carboxamide Formula: C17H19ClFN5O3 MolecularWeight: 395.815863

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=NC(=C1)N2CCN(CC2)C(=O)NC3=CC(=C(C=C3)F)Cl)OC

Isomeric SMILES

COC1=NC(=NC(=C1)N2CCN(CC2)C(=O)NC3=CC(=C(C=C3)F)Cl)OC

InChI

InChI=1S/C17H19ClFN5O3/c1-26-15-10-14(21-16(22-15)27-2)23-5-7-24(8-6-23)17(25)20-11-3-4-13(19)12(18)9-11/h3-4,9-10H,5-8H2,1-2H3,(H,20,25)