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

Systemtic Name: 2-[4-[(4-butyl-1,2-dimethyl-6-oxidanylidene-pyrimidin-5-yl)methyl]phenyl]benzenecarbonitrile Openeye Name: 2-[4-[(4-butyl-1,2-dimethyl-6-oxo-pyrimidin-5-yl)methyl]phenyl]benzonitrile CAS Name: 2-[4-[(4-butyl-1,2-dimethyl-6-oxo-5-pyrimidinyl)methyl]phenyl]benzonitrile IUPAC Name: 2-[4-[(4-butyl-1,2-dimethyl-6-oxopyrimidin-5-yl)methyl]phenyl]benzonitrile Traditional Name: 2-[4-[(4-butyl-6-keto-1,2-dimethyl-pyrimidin-5-yl)methyl]phenyl]benzonitrile Formula: C24H25N3O MolecularWeight: 371.4748

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=O)N(C(=N1)C)C)CC2=CC=C(C=C2)C3=CC=CC=C3C#N

Isomeric SMILES

CCCCC1=C(C(=O)N(C(=N1)C)C)CC2=CC=C(C=C2)C3=CC=CC=C3C#N

InChI

InChI=1S/C24H25N3O/c1-4-5-10-23-22(24(28)27(3)17(2)26-23)15-18-11-13-19(14-12-18)21-9-7-6-8-20(21)16-25/h6-9,11-14H,4-5,10,15H2,1-3H3