Chem
J-GLOBAL ID：200907034975610715   Nikkaji number：J2.403.959E

TMI-1

(3S)-N-ヒドロキシ-2,2-ジメチル-4-[4-(2-ブチニルオキシ)フェニルスルホニル]チオモルホリン-3-カルボアミド
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C17H22N2O5S2
Molecular formula furigana： C17-H22-N2-O5-S2
Molecular weight： 398.490
InChI： InChI=1S/C17H22N2O5S2/c1-4-5-11-24-13-6-8-14(9-7-13)26(22,23)19-10-12-25-17(2,3)15(19)16(20)18-21/h6-9,15,21H,10-12H2,1-3H3,(H,18,20)/t15-/m0/s1
InChI key： CVZIHNYAZLXRRS-HNNXBMFYSA-N
SMILES： CC#CCOc1ccc(cc1)S(=O)(=O)N1CCSC(C)(C)[C@@H]1C(=O)NO
Systematic name  (3)：
  • (3S)-N-ヒドロキシ-2,2-ジメチル-4-[4-(2-ブチニルオキシ)フェニルスルホニル]チオモルホリン-3-カルボアミド
  • (3S)-4-[4-(ブタ-2-イン-1-イルオキシ)ベンゼンスルホニル]-N-ヒドロキシ-2,2-ジメチルチオモルホリン-3-カルボキサミド
  • (3S)-4-[4-(but-2-yn-1-yloxy)benzenesulfonyl]-N-hydroxy-2,2-dimethylthiomorpholine-3-carboxamide
Other name (2)：
  • (3S)-N-Hydroxy-2,2-dimethyl-4-[4-(2-butynyloxy)phenylsulfonyl]thiomorpholine-3-carboxamide
  • TMI-1
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