2-methylsulfanyl-5-oxidanylidene-4-(4-propan-2-ylphenyl)-4,4a,6,7-tetrahydro-1H-quinoline-3-carbonitrile

Systemtic Name: 2-methylsulfanyl-5-oxidanylidene-4-(4-propan-2-ylphenyl)-4,4a,6,7-tetrahydro-1H-quinoline-3-carbonitrile Openeye Name: 4-(4-isopropylphenyl)-2-methylsulfanyl-5-oxo-4,4a,6,7-tetrahydro-1H-quinoline-3-carbonitrile CAS Name: 2-(methylthio)-5-oxo-4-(4-propan-2-ylphenyl)-4,4a,6,7-tetrahydro-1H-quinoline-3-carbonitrile IUPAC Name: 2-methylsulfanyl-5-oxo-4-(4-propan-2-ylphenyl)-4,4a,6,7-tetrahydro-1H-quinoline-3-carbonitrile Traditional Name: 5-keto-2-(methylthio)-4-p-cumenyl-4,4a,6,7-tetrahydro-1H-quinoline-3-carbonitrile Formula: C20H22N2OS MolecularWeight: 338.46648

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2C3C(=O)CCC=C3NC(=C2C#N)SC

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2C3C(=O)CCC=C3NC(=C2C#N)SC

InChI

InChI=1S/C20H22N2OS/c1-12(2)13-7-9-14(10-8-13)18-15(11-21)20(24-3)22-16-5-4-6-17(23)19(16)18/h5,7-10,12,18-19,22H,4,6H2,1-3H3