2-azanyl-1-(3-chloranyl-2-methyl-phenyl)-7,7-dimethyl-4-(5-methyl-2-methylsulfanyl-thiophen-3-yl)-5-oxidanylidene-6,8-dihydro-4H-quinoline-3-carbonitrile

Systemtic Name: 2-azanyl-1-(3-chloranyl-2-methyl-phenyl)-7,7-dimethyl-4-(5-methyl-2-methylsulfanyl-thiophen-3-yl)-5-oxidanylidene-6,8-dihydro-4H-quinoline-3-carbonitrile Openeye Name: 2-amino-1-(3-chloro-2-methyl-phenyl)-7,7-dimethyl-4-(5-methyl-2-methylsulfanyl-3-thienyl)-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile CAS Name: 2-amino-1-(3-chloro-2-methylphenyl)-7,7-dimethyl-4-[5-methyl-2-(methylthio)-3-thiophenyl]-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile IUPAC Name: 2-amino-1-(3-chloro-2-methylphenyl)-7,7-dimethyl-4-(5-methyl-2-methylsulfanylthiophen-3-yl)-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile Traditional Name: 2-amino-1-(3-chloro-2-methyl-phenyl)-5-keto-7,7-dimethyl-4-[5-methyl-2-(methylthio)-3-thienyl]-6,8-dihydro-4H-quinoline-3-carbonitrile Formula: C25H26ClN3OS2 MolecularWeight: 484.07644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)SC)C2C(=C(N(C3=C2C(=O)CC(C3)(C)C)C4=C(C(=CC=C4)Cl)C)N)C#N

Isomeric SMILES

CC1=CC(=C(S1)SC)C2C(=C(N(C3=C2C(=O)CC(C3)(C)C)C4=C(C(=CC=C4)Cl)C)N)C#N

InChI

InChI=1S/C25H26ClN3OS2/c1-13-9-15(24(31-5)32-13)21-16(12-27)23(28)29(18-8-6-7-17(26)14(18)2)19-10-25(3,4)11-20(30)22(19)21/h6-9,21H,10-11,28H2,1-5H3