4-[5-ethyl-6-oxidanylidene-1-prop-2-ynyl-4-(trifluoromethyl)pyrimidin-2-yl]pyridine-2-carbonitrile

Systemtic Name: 4-[5-ethyl-6-oxidanylidene-1-prop-2-ynyl-4-(trifluoromethyl)pyrimidin-2-yl]pyridine-2-carbonitrile Openeye Name: 4-[5-ethyl-6-oxo-1-prop-2-ynyl-4-(trifluoromethyl)pyrimidin-2-yl]pyridine-2-carbonitrile CAS Name: 4-[5-ethyl-6-oxo-1-prop-2-ynyl-4-(trifluoromethyl)-2-pyrimidinyl]-2-pyridinecarbonitrile IUPAC Name: 4-[5-ethyl-6-oxo-1-prop-2-ynyl-4-(trifluoromethyl)pyrimidin-2-yl]pyridine-2-carbonitrile Traditional Name: 4-[5-ethyl-6-keto-1-propargyl-4-(trifluoromethyl)pyrimidin-2-yl]picolinonitrile Formula: C16H11F3N4O MolecularWeight: 332.27995

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H11F3N4O/c1-3-7-23-14(10-5-6-21-11(8-10)9-20)22-13(16(17,18)19)12(4-2)15(23)24/h1,5-6,8H,4,7H2,2H3