2-[4-[2-methoxy-8-(2-pyridin-3-ylethynyl)imidazo[4,5-c]quinolin-1-yl]phenyl]-2-methyl-propanenitrile

Systemtic Name: 2-[4-[2-methoxy-8-(2-pyridin-3-ylethynyl)imidazo[4,5-c]quinolin-1-yl]phenyl]-2-methyl-propanenitrile Openeye Name: 2-[4-[2-methoxy-8-[2-(3-pyridyl)ethynyl]imidazo[4,5-c]quinolin-1-yl]phenyl]-2-methyl-propanenitrile CAS Name: 2-[4-[2-methoxy-8-[2-(3-pyridinyl)ethynyl]-1-imidazo[4,5-c]quinolinyl]phenyl]-2-methylpropanenitrile IUPAC Name: 2-[4-[2-methoxy-8-(2-pyridin-3-ylethynyl)imidazo[4,5-c]quinolin-1-yl]phenyl]-2-methylpropanenitrile Traditional Name: 2-[4-[2-methoxy-8-[2-(3-pyridyl)ethynyl]imidazo[4,5-c]quinolin-1-yl]phenyl]-2-methyl-propionitrile Formula: C28H21N5O MolecularWeight: 443.49924

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#N)C1=CC=C(C=C1)N2C3=C4C=C(C=CC4=NC=C3N=C2OC)C#CC5=CN=CC=C5

Isomeric SMILES

CC(C)(C#N)C1=CC=C(C=C1)N2C3=C4C=C(C=CC4=NC=C3N=C2OC)C#CC5=CN=CC=C5

InChI

InChI=1S/C28H21N5O/c1-28(2,18-29)21-9-11-22(12-10-21)33-26-23-15-19(6-7-20-5-4-14-30-16-20)8-13-24(23)31-17-25(26)32-27(33)34-3/h4-5,8-17H,1-3H3