2-azanyl-1-(2-chloranylpyridin-3-yl)-4-(2,4-dimethylphenyl)-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-quinoline-3-carbonitrile

Systemtic Name: 2-azanyl-1-(2-chloranylpyridin-3-yl)-4-(2,4-dimethylphenyl)-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-quinoline-3-carbonitrile Openeye Name: 2-amino-1-(2-chloro-3-pyridyl)-4-(2,4-dimethylphenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile CAS Name: 2-amino-1-(2-chloro-3-pyridinyl)-4-(2,4-dimethylphenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile IUPAC Name: 2-amino-1-(2-chloropyridin-3-yl)-4-(2,4-dimethylphenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile Traditional Name: 2-amino-1-(2-chloro-3-pyridyl)-4-(2,4-dimethylphenyl)-5-keto-7,7-dimethyl-6,8-dihydro-4H-quinoline-3-carbonitrile Formula: C25H25ClN4O MolecularWeight: 432.9452

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2C(=C(N(C3=C2C(=O)CC(C3)(C)C)C4=C(N=CC=C4)Cl)N)C#N)C

Isomeric SMILES

CC1=CC(=C(C=C1)C2C(=C(N(C3=C2C(=O)CC(C3)(C)C)C4=C(N=CC=C4)Cl)N)C#N)C

InChI

InChI=1S/C25H25ClN4O/c1-14-7-8-16(15(2)10-14)21-17(13-27)24(28)30(18-6-5-9-29-23(18)26)19-11-25(3,4)12-20(31)22(19)21/h5-10,21H,11-12,28H2,1-4H3