2-[(4-chloranyl-1-methyl-6-oxidanylidene-2-phenyl-pyrimidin-5-yl)methyl]benzenecarbonitrile

Systemtic Name: 2-[(4-chloranyl-1-methyl-6-oxidanylidene-2-phenyl-pyrimidin-5-yl)methyl]benzenecarbonitrile Openeye Name: 2-[(4-chloro-1-methyl-6-oxo-2-phenyl-pyrimidin-5-yl)methyl]benzonitrile CAS Name: 2-[(4-chloro-1-methyl-6-oxo-2-phenyl-5-pyrimidinyl)methyl]benzonitrile IUPAC Name: 2-[(4-chloro-1-methyl-6-oxo-2-phenylpyrimidin-5-yl)methyl]benzonitrile Traditional Name: 2-[(4-chloro-6-keto-1-methyl-2-phenyl-pyrimidin-5-yl)methyl]benzonitrile Formula: C19H14ClN3O MolecularWeight: 335.78696

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC(=C(C1=O)CC2=CC=CC=C2C#N)Cl)C3=CC=CC=C3

Isomeric SMILES

CN1C(=NC(=C(C1=O)CC2=CC=CC=C2C#N)Cl)C3=CC=CC=C3

InChI

InChI=1S/C19H14ClN3O/c1-23-18(13-7-3-2-4-8-13)22-17(20)16(19(23)24)11-14-9-5-6-10-15(14)12-21/h2-10H,11H2,1H3