S-[2-[(2-chloranyl-4-methylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl] 6-methyl-3,4-dihydro-2H-quinoline-1-carbothioate

Systemtic Name: S-[2-[(2-chloranyl-4-methylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl] 6-methyl-3,4-dihydro-2H-quinoline-1-carbothioate Openeye Name: S-[2-(2-chloro-4-methylsulfonyl-anilino)-2-oxo-ethyl] 6-methyl-3,4-dihydro-2H-quinoline-1-carbothioate CAS Name: 6-methyl-3,4-dihydro-2H-quinoline-1-carbothioic acid S-[2-(2-chloro-4-methylsulfonylanilino)-2-oxoethyl] ester IUPAC Name: S-[2-(2-chloro-4-methylsulfonylanilino)-2-oxoethyl] 6-methyl-3,4-dihydro-2H-quinoline-1-carbothioate Traditional Name: 6-methyl-3,4-dihydro-2H-quinoline-1-carbothioic acid S-[2-(2-chloro-4-mesyl-anilino)-2-keto-ethyl] ester Formula: C20H21ClN2O4S2 MolecularWeight: 452.97474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(CCC2)C(=O)SCC(=O)NC3=C(C=C(C=C3)S(=O)(=O)C)Cl

Isomeric SMILES

CC1=CC2=C(C=C1)N(CCC2)C(=O)SCC(=O)NC3=C(C=C(C=C3)S(=O)(=O)C)Cl

InChI

InChI=1S/C20H21ClN2O4S2/c1-13-5-8-18-14(10-13)4-3-9-23(18)20(25)28-12-19(24)22-17-7-6-15(11-16(17)21)29(2,26)27/h5-8,10-11H,3-4,9,12H2,1-2H3,(H,22,24)