5,6-diethyl-2-(3-fluorophenyl)-3-prop-2-ynyl-pyrimidin-4-one

Systemtic Name: 5,6-diethyl-2-(3-fluorophenyl)-3-prop-2-ynyl-pyrimidin-4-one Openeye Name: 5,6-diethyl-2-(3-fluorophenyl)-3-prop-2-ynyl-pyrimidin-4-one CAS Name: 5,6-diethyl-2-(3-fluorophenyl)-3-prop-2-ynyl-4-pyrimidinone IUPAC Name: 5,6-diethyl-2-(3-fluorophenyl)-3-prop-2-ynylpyrimidin-4-one Traditional Name: 5,6-diethyl-2-(3-fluorophenyl)-3-propargyl-pyrimidin-4-one Formula: C17H17FN2O MolecularWeight: 284.328083

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17FN2O/c1-4-10-20-16(12-8-7-9-13(18)11-12)19-15(6-3)14(5-2)17(20)21/h1,7-9,11H,5-6,10H2,2-3H3