6-methyl-5-(phenylmethyl)-2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]-1H-pyrimidin-4-one

Systemtic Name: 6-methyl-5-(phenylmethyl)-2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]-1H-pyrimidin-4-one Openeye Name: 5-benzyl-6-methyl-2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]-1H-pyrimidin-4-one CAS Name: 6-methyl-5-(phenylmethyl)-2-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]-1H-pyrimidin-4-one IUPAC Name: 5-benzyl-6-methyl-2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]-1H-pyrimidin-4-one Traditional Name: 5-benzyl-6-methyl-2-[4-[3-(trifluoromethyl)phenyl]piperazino]-1H-pyrimidin-4-one Formula: C23H23F3N4O MolecularWeight: 428.45013

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)N2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F)CC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=O)N=C(N1)N2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F)CC4=CC=CC=C4

InChI

InChI=1S/C23H23F3N4O/c1-16-20(14-17-6-3-2-4-7-17)21(31)28-22(27-16)30-12-10-29(11-13-30)19-9-5-8-18(15-19)23(24,25)26/h2-9,15H,10-14H2,1H3,(H,27,28,31)