2-azanyl-1-(3-chloranyl-4-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-4-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-4-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-4-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-4-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-4-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=C(C=C(C=C1)N2C3=C(C(C(=C2N)C#N)C4=C(SC(=C4)C)SC)C(=O)CC(C3)(C)C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N2C3=C(C(C(=C2N)C#N)C4=C(SC(=C4)C)SC)C(=O)CC(C3)(C)C)Cl

InChI

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