4-(4-cyanophenyl)-1-[(3,5-dimethyl-4-oxidanylidene-1H-pyridin-2-yl)methyl]-2,5-dimethyl-pyrrole-3-carbonitrile

Systemtic Name: 4-(4-cyanophenyl)-1-[(3,5-dimethyl-4-oxidanylidene-1H-pyridin-2-yl)methyl]-2,5-dimethyl-pyrrole-3-carbonitrile Openeye Name: 4-(4-cyanophenyl)-1-[(3,5-dimethyl-4-oxo-1H-pyridin-2-yl)methyl]-2,5-dimethyl-pyrrole-3-carbonitrile CAS Name: 4-(4-cyanophenyl)-1-[(3,5-dimethyl-4-oxo-1H-pyridin-2-yl)methyl]-2,5-dimethyl-3-pyrrolecarbonitrile IUPAC Name: 4-(4-cyanophenyl)-1-[(3,5-dimethyl-4-oxo-1H-pyridin-2-yl)methyl]-2,5-dimethylpyrrole-3-carbonitrile Traditional Name: 4-(4-cyanophenyl)-1-[(4-keto-3,5-dimethyl-1H-pyridin-2-yl)methyl]-2,5-dimethyl-pyrrole-3-carbonitrile Formula: C22H20N4O MolecularWeight: 356.4204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CNC(=C(C1=O)C)CN2C(=C(C(=C2C)C3=CC=C(C=C3)C#N)C#N)C

Isomeric SMILES

CC1=CNC(=C(C1=O)C)CN2C(=C(C(=C2C)C3=CC=C(C=C3)C#N)C#N)C

InChI

InChI=1S/C22H20N4O/c1-13-11-25-20(14(2)22(13)27)12-26-15(3)19(10-24)21(16(26)4)18-7-5-17(9-23)6-8-18/h5-8,11H,12H2,1-4H3,(H,25,27)