5-[(4-butyl-6-ethenyl-2-methyl-pyrimidin-5-yl)methyl]-2-phenyl-benzenecarbonitrile

Systemtic Name: 5-[(4-butyl-6-ethenyl-2-methyl-pyrimidin-5-yl)methyl]-2-phenyl-benzenecarbonitrile Openeye Name: 5-[(4-butyl-2-methyl-6-vinyl-pyrimidin-5-yl)methyl]-2-phenyl-benzonitrile CAS Name: 5-[(4-butyl-6-ethenyl-2-methyl-5-pyrimidinyl)methyl]-2-phenylbenzonitrile IUPAC Name: 5-[(4-butyl-6-ethenyl-2-methylpyrimidin-5-yl)methyl]-2-phenylbenzonitrile Traditional Name: 5-[(4-butyl-2-methyl-6-vinyl-pyrimidin-5-yl)methyl]-2-phenyl-benzonitrile Formula: C25H25N3 MolecularWeight: 367.4861

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=NC(=C1CC2=CC(=C(C=C2)C3=CC=CC=C3)C#N)C=C)C

Isomeric SMILES

CCCCC1=NC(=NC(=C1CC2=CC(=C(C=C2)C3=CC=CC=C3)C#N)C=C)C

InChI

InChI=1S/C25H25N3/c1-4-6-12-25-23(24(5-2)27-18(3)28-25)16-19-13-14-22(21(15-19)17-26)20-10-8-7-9-11-20/h5,7-11,13-15H,2,4,6,12,16H2,1,3H3