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

Systemtic Name: S-[2-[(2-chloranyl-4-sulfamoyl-phenyl)amino]-2-oxidanylidene-ethyl] 6-fluoranyl-2-methyl-3,4-dihydro-2H-quinoline-1-carbothioate Openeye Name: S-[2-(2-chloro-4-sulfamoyl-anilino)-2-oxo-ethyl] 6-fluoro-2-methyl-3,4-dihydro-2H-quinoline-1-carbothioate CAS Name: 6-fluoro-2-methyl-3,4-dihydro-2H-quinoline-1-carbothioic acid S-[2-(2-chloro-4-sulfamoylanilino)-2-oxoethyl] ester IUPAC Name: S-[2-(2-chloro-4-sulfamoylanilino)-2-oxoethyl] 6-fluoro-2-methyl-3,4-dihydro-2H-quinoline-1-carbothioate Traditional Name: 6-fluoro-2-methyl-3,4-dihydro-2H-quinoline-1-carbothioic acid S-[2-(2-chloro-4-sulfamoyl-anilino)-2-keto-ethyl] ester Formula: C19H19ClFN3O4S2 MolecularWeight: 471.953263

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(N1C(=O)SCC(=O)NC3=C(C=C(C=C3)S(=O)(=O)N)Cl)C=CC(=C2)F

Isomeric SMILES

CC1CCC2=C(N1C(=O)SCC(=O)NC3=C(C=C(C=C3)S(=O)(=O)N)Cl)C=CC(=C2)F

InChI

InChI=1S/C19H19ClFN3O4S2/c1-11-2-3-12-8-13(21)4-7-17(12)24(11)19(26)29-10-18(25)23-16-6-5-14(9-15(16)20)30(22,27)28/h4-9,11H,2-3,10H2,1H3,(H,23,25)(H2,22,27,28)