2-azanyl-1-[2-chloranyl-5-(trifluoromethyl)phenyl]-7,7-dimethyl-5-oxidanylidene-4-pyridin-3-yl-6,8-dihydro-4H-quinoline-3-carbonitrile

Systemtic Name: 2-azanyl-1-[2-chloranyl-5-(trifluoromethyl)phenyl]-7,7-dimethyl-5-oxidanylidene-4-pyridin-3-yl-6,8-dihydro-4H-quinoline-3-carbonitrile Openeye Name: 2-amino-1-[2-chloro-5-(trifluoromethyl)phenyl]-7,7-dimethyl-5-oxo-4-(3-pyridyl)-6,8-dihydro-4H-quinoline-3-carbonitrile CAS Name: 2-amino-1-[2-chloro-5-(trifluoromethyl)phenyl]-7,7-dimethyl-5-oxo-4-(3-pyridinyl)-6,8-dihydro-4H-quinoline-3-carbonitrile IUPAC Name: 2-amino-1-[2-chloro-5-(trifluoromethyl)phenyl]-7,7-dimethyl-5-oxo-4-pyridin-3-yl-6,8-dihydro-4H-quinoline-3-carbonitrile Traditional Name: 2-amino-1-[2-chloro-5-(trifluoromethyl)phenyl]-5-keto-7,7-dimethyl-4-(3-pyridyl)-6,8-dihydro-4H-quinoline-3-carbonitrile Formula: C24H20ClF3N4O MolecularWeight: 472.89001

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(C(=C(N2C3=C(C=CC(=C3)C(F)(F)F)Cl)N)C#N)C4=CN=CC=C4)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C(C(=C(N2C3=C(C=CC(=C3)C(F)(F)F)Cl)N)C#N)C4=CN=CC=C4)C(=O)C1)C

InChI

InChI=1S/C24H20ClF3N4O/c1-23(2)9-18-21(19(33)10-23)20(13-4-3-7-31-12-13)15(11-29)22(30)32(18)17-8-14(24(26,27)28)5-6-16(17)25/h3-8,12,20H,9-10,30H2,1-2H3