N-(5-fluoranyl-2-methyl-phenyl)-4-pyrimidin-2-yl-piperazine-1-carboxamide

Systemtic Name: N-(5-fluoranyl-2-methyl-phenyl)-4-pyrimidin-2-yl-piperazine-1-carboxamide Openeye Name: N-(5-fluoro-2-methyl-phenyl)-4-pyrimidin-2-yl-piperazine-1-carboxamide CAS Name: N-(5-fluoro-2-methylphenyl)-4-(2-pyrimidinyl)-1-piperazinecarboxamide IUPAC Name: N-(5-fluoro-2-methylphenyl)-4-pyrimidin-2-ylpiperazine-1-carboxamide Traditional Name: N-(5-fluoro-2-methyl-phenyl)-4-(2-pyrimidyl)piperazine-1-carboxamide Formula: C16H18FN5O MolecularWeight: 315.345423

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)F)NC(=O)N2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

CC1=C(C=C(C=C1)F)NC(=O)N2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C16H18FN5O/c1-12-3-4-13(17)11-14(12)20-16(23)22-9-7-21(8-10-22)15-18-5-2-6-19-15/h2-6,11H,7-10H2,1H3,(H,20,23)