N-(4-methylphenyl)-4-[5-(trifluoromethyl)pyrimidin-2-yl]piperazine-1-carboxamide

Systemtic Name: N-(4-methylphenyl)-4-[5-(trifluoromethyl)pyrimidin-2-yl]piperazine-1-carboxamide Openeye Name: N-(p-tolyl)-4-[5-(trifluoromethyl)pyrimidin-2-yl]piperazine-1-carboxamide CAS Name: N-(4-methylphenyl)-4-[5-(trifluoromethyl)-2-pyrimidinyl]-1-piperazinecarboxamide IUPAC Name: N-(4-methylphenyl)-4-[5-(trifluoromethyl)pyrimidin-2-yl]piperazine-1-carboxamide Traditional Name: N-(p-tolyl)-4-[5-(trifluoromethyl)pyrimidin-2-yl]piperazine-1-carboxamide Formula: C17H18F3N5O MolecularWeight: 365.35293

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18F3N5O/c1-12-2-4-14(5-3-12)23-16(26)25-8-6-24(7-9-25)15-21-10-13(11-22-15)17(18,19)20/h2-5,10-11H,6-9H2,1H3,(H,23,26)