2-[4-(2-chlorophenyl)-6-oxidanylidene-2-phenyl-pyrimidin-1-yl]ethanenitrile

Systemtic Name: 2-[4-(2-chlorophenyl)-6-oxidanylidene-2-phenyl-pyrimidin-1-yl]ethanenitrile Openeye Name: 2-[4-(2-chlorophenyl)-6-oxo-2-phenyl-pyrimidin-1-yl]acetonitrile CAS Name: 2-[4-(2-chlorophenyl)-6-oxo-2-phenyl-1-pyrimidinyl]acetonitrile IUPAC Name: 2-[4-(2-chlorophenyl)-6-oxo-2-phenylpyrimidin-1-yl]acetonitrile Traditional Name: 2-[4-(2-chlorophenyl)-6-keto-2-phenyl-pyrimidin-1-yl]acetonitrile Formula: C18H12ClN3O MolecularWeight: 321.76038

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=CC(=O)N2CC#N)C3=CC=CC=C3Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=CC(=O)N2CC#N)C3=CC=CC=C3Cl

InChI

InChI=1S/C18H12ClN3O/c19-15-9-5-4-8-14(15)16-12-17(23)22(11-10-20)18(21-16)13-6-2-1-3-7-13/h1-9,12H,11H2