(E)-1-(4-pyrimidin-2-ylpiperazin-1-yl)-3-[3-(trifluoromethyl)phenyl]prop-2-en-1-one

Systemtic Name: (E)-1-(4-pyrimidin-2-ylpiperazin-1-yl)-3-[3-(trifluoromethyl)phenyl]prop-2-en-1-one Openeye Name: (E)-1-(4-pyrimidin-2-ylpiperazin-1-yl)-3-[3-(trifluoromethyl)phenyl]prop-2-en-1-one CAS Name: (E)-1-[4-(2-pyrimidinyl)-1-piperazinyl]-3-[3-(trifluoromethyl)phenyl]-2-propen-1-one IUPAC Name: (E)-1-(4-pyrimidin-2-ylpiperazin-1-yl)-3-[3-(trifluoromethyl)phenyl]prop-2-en-1-one Traditional Name: (E)-1-[4-(2-pyrimidyl)piperazino]-3-[3-(trifluoromethyl)phenyl]prop-2-en-1-one Formula: C18H17F3N4O MolecularWeight: 362.34899

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)C=CC3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)/C=C/C3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C18H17F3N4O/c19-18(20,21)15-4-1-3-14(13-15)5-6-16(26)24-9-11-25(12-10-24)17-22-7-2-8-23-17/h1-8,13H,9-12H2/b6-5+