N-(3-chloranyl-4-fluoranyl-phenyl)-4-[6-(4-methylpiperidin-1-yl)pyrimidin-4-yl]piperazine-1-carboxamide

Systemtic Name: N-(3-chloranyl-4-fluoranyl-phenyl)-4-[6-(4-methylpiperidin-1-yl)pyrimidin-4-yl]piperazine-1-carboxamide Openeye Name: N-(3-chloro-4-fluoro-phenyl)-4-[6-(4-methyl-1-piperidyl)pyrimidin-4-yl]piperazine-1-carboxamide CAS Name: N-(3-chloro-4-fluorophenyl)-4-[6-(4-methyl-1-piperidinyl)-4-pyrimidinyl]-1-piperazinecarboxamide IUPAC Name: N-(3-chloro-4-fluorophenyl)-4-[6-(4-methylpiperidin-1-yl)pyrimidin-4-yl]piperazine-1-carboxamide Traditional Name: N-(3-chloro-4-fluoro-phenyl)-4-[6-(4-methylpiperidino)pyrimidin-4-yl]piperazine-1-carboxamide Formula: C21H26ClFN6O MolecularWeight: 432.922143

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=CC(=NC=N2)N3CCN(CC3)C(=O)NC4=CC(=C(C=C4)F)Cl

Isomeric SMILES

CC1CCN(CC1)C2=CC(=NC=N2)N3CCN(CC3)C(=O)NC4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C21H26ClFN6O/c1-15-4-6-27(7-5-15)19-13-20(25-14-24-19)28-8-10-29(11-9-28)21(30)26-16-2-3-18(23)17(22)12-16/h2-3,12-15H,4-11H2,1H3,(H,26,30)