2-(3-Methoxyphenyl)-3,4-Dihydro-2H-Thieno[3,2-E][1,2]Thiazine-6-Sulfonamide 1,1-Dioxide

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Formula C13H14N2O5S3
IUPAC Name (2r)-2-(3-methoxyphenyl)-1,1-dioxo-3,4-dihydrothieno[3,2-e]thiazine-6-sulfonamide
Molecular Mass 374.456 g·mol−1
Heat of Formation -580.6 ± 16.7 kJ·mol−1
Dipole Moment 5.41 ± 1.08 D
Volume 376.56 Å 3
Surface Area 332.31 Å 2
HOMO Energy -8.81 ± 0.55 eV
LUMO Energy 1.40 ± eV
Point Group Symmetry C1
Synonyms
  • 1,1-diketo-2-(3-methoxyphenyl)-3,4-dihydrothieno[4,5-e]thiazine-6-sulfonamide
  • 2-(3-methoxyphenyl)-1,1-dioxo-3,4-dihydrothieno[4,5-e][1,2]thiazine-6-sulfonamide
  • 2-(3-methoxyphenyl)-1,1-dioxo-3,4-dihydrothieno[4,5-e]thiazine-6-sulfonamide
  • 3,,4-dihydro-2-(3-methoxyphenyl)-2h-thieno-[3,2-e]-1,2-thiazine-6-sulfonamide-1,1-dioxide
  • al1
  • al7182
InChIKey ICIXQGGQPKFQRL-UHFFFAOYSA-N
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