S-{2-[(2-Chloro-4-Sulfamoylphenyl)Amino]-2-Oxoethyl} 6,8-Dichloro-3,4-Dihydro-1(2H)-Quinolinecarbothioate

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Formula C18H16Cl3N3O4S2
IUPAC Name s-[2-(2-chloro-4-sulfamoyl-anilino)-2-oxo-ethyl] 6,8-dichloro-3,4-dihydro-2h-quinoline-1-carbothioate
Molecular Mass 508.826 g·mol−1
Heat of Formation -595.8 ± 16.7 kJ·mol−1
Dipole Moment 8.66 ± 1.08 D
Volume 515.76 Å 3
Surface Area 435.62 Å 2
HOMO Energy -9.48 ± 0.55 eV
LUMO Energy -1.25 ± eV
Point Group Symmetry C1
Synonyms
  • 6,8-dichloro-3,4-dihydro-2h-quinoline-1-carbothioic acid s-[2-[(2-chloro-4-sulfamoyl-phenyl)amino]-2-keto-ethyl] ester
  • 6,8-dichloro-3,4-dihydro-2h-quinoline-1-carbothioic acid s-[2-[(2-chloro-4-sulfamoylphenyl)amino]-2-oxoethyl] ester
  • s-[2-[(2-chloro-4-sulfamoyl-phenyl)amino]-2-oxo-ethyl] 6,8-dichloro-3,4-dihydro-2h-quinoline-1-carbothioate
  • s-[2-[(2-chloro-4-sulfamoylphenyl)amino]-2-oxoethyl] 6,8-dichloro-3,4-dihydro-2h-quinoline-1-carbothioate
InChIKey SZLMFNKKFJUHKQ-UHFFFAOYSA-N
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Elements C Cl H O N S