2-(4-ethyl-6-oxidanylidene-2-phenyl-1-prop-2-ynyl-pyrimidin-5-yl)ethanenitrile

Systemtic Name: 2-(4-ethyl-6-oxidanylidene-2-phenyl-1-prop-2-ynyl-pyrimidin-5-yl)ethanenitrile Openeye Name: 2-(4-ethyl-6-oxo-2-phenyl-1-prop-2-ynyl-pyrimidin-5-yl)acetonitrile CAS Name: 2-(4-ethyl-6-oxo-2-phenyl-1-prop-2-ynyl-5-pyrimidinyl)acetonitrile IUPAC Name: 2-(4-ethyl-6-oxo-2-phenyl-1-prop-2-ynylpyrimidin-5-yl)acetonitrile Traditional Name: 2-(4-ethyl-6-keto-2-phenyl-1-propargyl-pyrimidin-5-yl)acetonitrile Formula: C17H15N3O MolecularWeight: 277.3205

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=O)N(C(=N1)C2=CC=CC=C2)CC#C)CC#N

Isomeric SMILES

CCC1=C(C(=O)N(C(=N1)C2=CC=CC=C2)CC#C)CC#N

InChI

InChI=1S/C17H15N3O/c1-3-12-20-16(13-8-6-5-7-9-13)19-15(4-2)14(10-11-18)17(20)21/h1,5-9H,4,10,12H2,2H3