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

Systemtic Name: 2-azanyl-4-[5-[[2,5-bis(chloranyl)phenyl]sulfanylmethyl]-2,4-dimethyl-phenyl]-1-[4-chloranyl-2-(trifluoromethyl)phenyl]-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-quinoline-3-carbonitrile Openeye Name: 2-amino-1-[4-chloro-2-(trifluoromethyl)phenyl]-4-[5-[(2,5-dichlorophenyl)sulfanylmethyl]-2,4-dimethyl-phenyl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile CAS Name: 2-amino-1-[4-chloro-2-(trifluoromethyl)phenyl]-4-[5-[[(2,5-dichlorophenyl)thio]methyl]-2,4-dimethylphenyl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile IUPAC Name: 2-amino-1-[4-chloro-2-(trifluoromethyl)phenyl]-4-[5-[(2,5-dichlorophenyl)sulfanylmethyl]-2,4-dimethylphenyl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile Traditional Name: 2-amino-1-[4-chloro-2-(trifluoromethyl)phenyl]-4-[5-[[(2,5-dichlorophenyl)thio]methyl]-2,4-dimethyl-phenyl]-5-keto-7,7-dimethyl-6,8-dihydro-4H-quinoline-3-carbonitrile Formula: C34H29Cl3F3N3OS MolecularWeight: 691.03277

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C2C(=C(N(C3=C2C(=O)CC(C3)(C)C)C4=C(C=C(C=C4)Cl)C(F)(F)F)N)C#N)CSC5=C(C=CC(=C5)Cl)Cl)C

Isomeric SMILES

CC1=CC(=C(C=C1C2C(=C(N(C3=C2C(=O)CC(C3)(C)C)C4=C(C=C(C=C4)Cl)C(F)(F)F)N)C#N)CSC5=C(C=CC(=C5)Cl)Cl)C

InChI

InChI=1S/C34H29Cl3F3N3OS/c1-17-9-18(2)22(10-19(17)16-45-29-12-21(36)5-7-25(29)37)30-23(15-41)32(42)43(27-13-33(3,4)14-28(44)31(27)30)26-8-6-20(35)11-24(26)34(38,39)40/h5-12,30H,13-14,16,42H2,1-4H3