methyl 2-[[3-cyano-4-(2-methylphenyl)-5-oxidanylidene-4,6,7,8-tetrahydro-1H-quinolin-2-yl]sulfanyl]ethanoate

Systemtic Name: methyl 2-[[3-cyano-4-(2-methylphenyl)-5-oxidanylidene-4,6,7,8-tetrahydro-1H-quinolin-2-yl]sulfanyl]ethanoate Openeye Name: methyl 2-[[3-cyano-4-(o-tolyl)-5-oxo-4,6,7,8-tetrahydro-1H-quinolin-2-yl]sulfanyl]acetate CAS Name: 2-[[3-cyano-4-(2-methylphenyl)-5-oxo-4,6,7,8-tetrahydro-1H-quinolin-2-yl]thio]acetic acid methyl ester IUPAC Name: methyl 2-[[3-cyano-4-(2-methylphenyl)-5-oxo-4,6,7,8-tetrahydro-1H-quinolin-2-yl]sulfanyl]acetate Traditional Name: 2-[[3-cyano-5-keto-4-(o-tolyl)-4,6,7,8-tetrahydro-1H-quinolin-2-yl]thio]acetic acid methyl ester Formula: C20H20N2O3S MolecularWeight: 368.4494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2C(=C(NC3=C2C(=O)CCC3)SCC(=O)OC)C#N

Isomeric SMILES

CC1=CC=CC=C1C2C(=C(NC3=C2C(=O)CCC3)SCC(=O)OC)C#N

InChI

InChI=1S/C20H20N2O3S/c1-12-6-3-4-7-13(12)18-14(10-21)20(26-11-17(24)25-2)22-15-8-5-9-16(23)19(15)18/h3-4,6-7,18,22H,5,8-9,11H2,1-2H3