3-methyl-3-[4-(3-methyl-2-oxidanylidene-8-pyridin-3-yl-imidazo[4,5-c]quinolin-1-yl)phenyl]pentanenitrile

Systemtic Name: 3-methyl-3-[4-(3-methyl-2-oxidanylidene-8-pyridin-3-yl-imidazo[4,5-c]quinolin-1-yl)phenyl]pentanenitrile Openeye Name: 3-methyl-3-[4-[3-methyl-2-oxo-8-(3-pyridyl)imidazo[4,5-c]quinolin-1-yl]phenyl]pentanenitrile CAS Name: 3-methyl-3-[4-[3-methyl-2-oxo-8-(3-pyridinyl)-1-imidazo[4,5-c]quinolinyl]phenyl]pentanenitrile IUPAC Name: 3-methyl-3-[4-(3-methyl-2-oxo-8-pyridin-3-ylimidazo[4,5-c]quinolin-1-yl)phenyl]pentanenitrile Traditional Name: 3-[4-[2-keto-3-methyl-8-(3-pyridyl)imidazo[4,5-c]quinolin-1-yl]phenyl]-3-methyl-valeronitrile Formula: C28H25N5O MolecularWeight: 447.531

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(CC#N)C1=CC=C(C=C1)N2C3=C4C=C(C=CC4=NC=C3N(C2=O)C)C5=CN=CC=C5

Isomeric SMILES

CCC(C)(CC#N)C1=CC=C(C=C1)N2C3=C4C=C(C=CC4=NC=C3N(C2=O)C)C5=CN=CC=C5

InChI

InChI=1S/C28H25N5O/c1-4-28(2,13-14-29)21-8-10-22(11-9-21)33-26-23-16-19(20-6-5-15-30-17-20)7-12-24(23)31-18-25(26)32(3)27(33)34/h5-12,15-18H,4,13H2,1-3H3