2-azanyl-1-(4-methoxyphenyl)-7,7-dimethyl-4-(4-methylsulfanylphenyl)-5-oxidanylidene-6,8-dihydro-4H-quinoline-3-carbonitrile

Systemtic Name: 2-azanyl-1-(4-methoxyphenyl)-7,7-dimethyl-4-(4-methylsulfanylphenyl)-5-oxidanylidene-6,8-dihydro-4H-quinoline-3-carbonitrile Openeye Name: 2-amino-1-(4-methoxyphenyl)-7,7-dimethyl-4-(4-methylsulfanylphenyl)-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile CAS Name: 2-amino-1-(4-methoxyphenyl)-7,7-dimethyl-4-[4-(methylthio)phenyl]-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile IUPAC Name: 2-amino-1-(4-methoxyphenyl)-7,7-dimethyl-4-(4-methylsulfanylphenyl)-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile Traditional Name: 2-amino-5-keto-1-(4-methoxyphenyl)-7,7-dimethyl-4-[4-(methylthio)phenyl]-6,8-dihydro-4H-quinoline-3-carbonitrile Formula: C26H27N3O2S MolecularWeight: 445.57648

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(C(=C(N2C3=CC=C(C=C3)OC)N)C#N)C4=CC=C(C=C4)SC)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C(C(=C(N2C3=CC=C(C=C3)OC)N)C#N)C4=CC=C(C=C4)SC)C(=O)C1)C

InChI

InChI=1S/C26H27N3O2S/c1-26(2)13-21-24(22(30)14-26)23(16-5-11-19(32-4)12-6-16)20(15-27)25(28)29(21)17-7-9-18(31-3)10-8-17/h5-12,23H,13-14,28H2,1-4H3