2-[3,5-bis(fluoranyl)phenyl]-5-ethyl-3-prop-2-ynyl-6-(trifluoromethyl)pyrimidin-4-one

Systemtic Name: 2-[3,5-bis(fluoranyl)phenyl]-5-ethyl-3-prop-2-ynyl-6-(trifluoromethyl)pyrimidin-4-one Openeye Name: 2-(3,5-difluorophenyl)-5-ethyl-3-prop-2-ynyl-6-(trifluoromethyl)pyrimidin-4-one CAS Name: 2-(3,5-difluorophenyl)-5-ethyl-3-prop-2-ynyl-6-(trifluoromethyl)-4-pyrimidinone IUPAC Name: 2-(3,5-difluorophenyl)-5-ethyl-3-prop-2-ynyl-6-(trifluoromethyl)pyrimidin-4-one Traditional Name: 2-(3,5-difluorophenyl)-5-ethyl-3-propargyl-6-(trifluoromethyl)pyrimidin-4-one Formula: C16H11F5N2O MolecularWeight: 342.263356

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C(N(C1=O)CC#C)C2=CC(=CC(=C2)F)F)C(F)(F)F

Isomeric SMILES

CCC1=C(N=C(N(C1=O)CC#C)C2=CC(=CC(=C2)F)F)C(F)(F)F

InChI

InChI=1S/C16H11F5N2O/c1-3-5-23-14(9-6-10(17)8-11(18)7-9)22-13(16(19,20)21)12(4-2)15(23)24/h1,6-8H,4-5H2,2H3