N-(4-fluorophenyl)-4-(2-methyl-6-piperidin-1-yl-pyrimidin-4-yl)piperazine-1-carboxamide

Systemtic Name: N-(4-fluorophenyl)-4-(2-methyl-6-piperidin-1-yl-pyrimidin-4-yl)piperazine-1-carboxamide Openeye Name: N-(4-fluorophenyl)-4-[2-methyl-6-(1-piperidyl)pyrimidin-4-yl]piperazine-1-carboxamide CAS Name: N-(4-fluorophenyl)-4-[2-methyl-6-(1-piperidinyl)-4-pyrimidinyl]-1-piperazinecarboxamide IUPAC Name: N-(4-fluorophenyl)-4-(2-methyl-6-piperidin-1-ylpyrimidin-4-yl)piperazine-1-carboxamide Traditional Name: N-(4-fluorophenyl)-4-(2-methyl-6-piperidino-pyrimidin-4-yl)piperazine-1-carboxamide Formula: C21H27FN6O MolecularWeight: 398.477083

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)N2CCN(CC2)C(=O)NC3=CC=C(C=C3)F)N4CCCCC4

Isomeric SMILES

CC1=NC(=CC(=N1)N2CCN(CC2)C(=O)NC3=CC=C(C=C3)F)N4CCCCC4

InChI

InChI=1S/C21H27FN6O/c1-16-23-19(26-9-3-2-4-10-26)15-20(24-16)27-11-13-28(14-12-27)21(29)25-18-7-5-17(22)6-8-18/h5-8,15H,2-4,9-14H2,1H3,(H,25,29)