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Thiomorpholine carboxylic acids and derivatives

Description:

Heterocyclic compounds containing a thiomorpholine ring substituted by one or more carboxylic acid groups (or derivative thereof). Thiomorpholine a six-membered aliphatic ring containing one nitrogen atom and one sulfur atom at positions 1 and 4 respectively, and four carbon atoms.
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6 Items

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  1. tert-butyl 3,3-dioxo-3-thia-6-azabicyclo[3.1.1]heptane-6-carboxylate
      Grade & Purity: 
    • ≥97%
    Cas Number: 1520084-19-8        Compound CID:  102218594
    Formula:  C10H17NO4S        Molecular Weight: 247.31
    SMILES:  CC(C)(C)OC(=O)N1C2CC1CS(=O)(=O)C2
    InChIKey: ABNDLXCLZZFFSQ-UHFFFAOYSA-N
    InChI:  InChI=1S/C10H17NO4S/c1-10(2,3)15-9(12)11-7-4-8(11)6-16(13,14)5-7/h7-8H,4-6H2,1-3H3
  2. tert-butyl 7-oxo-3-thia-9-azabicyclo[3.3.1]nonane-9-carboxylate
      Grade & Purity: 
    • ≥97%
    Cas Number: 1319257-00-5        Compound CID:  67294846
    Formula:  C12H19NO3S        Molecular Weight: 257.35
    SMILES:  CC(C)(C)OC(=O)N1C2CC(=O)CC1CSC2
    InChIKey: MFKUBEZLJIJNFP-UHFFFAOYSA-N
    InChI:  InChI=1S/C12H19NO3S/c1-12(2,3)16-11(15)13-8-4-10(14)5-9(13)7-17-6-8/h8-9H,4-7H2,1-3H3
  3. tert-butyl 3-thia-6-azabicyclo[3.1.1]heptane-6-carboxylate
      Grade & Purity: 
    • ≥97%
    Cas Number: 1520084-10-9        Compound CID:  102218592
    Formula:  C10H17NO2S        Molecular Weight: 215.31
    SMILES:  CC(C)(C)OC(=O)N1C2CC1CSC2
    InChIKey: NDDRKVOFPUVRFU-UHFFFAOYSA-N
    InChI:  InChI=1S/C10H17NO2S/c1-10(2,3)13-9(12)11-7-4-8(11)6-14-5-7/h7-8H,4-6H2,1-3H3
  4. tert-butyl 3-thia-8-azabicyclo[3.2.1]octane-8-carboxylate
      Grade & Purity: 
    • ≥97%
    Cas Number: 1520084-33-6        Compound CID:  102218596
    Formula:  C11H19NO2S        Molecular Weight: 229.34
    IUPAC Name:  tert-butyl 3-thia-8-azabicyclo[3.2.1]octane-8-carboxylate
    SMILES:  CC(C)(C)OC(=O)N1C2CCC1CSC2
    InChIKey: FQCMYIYCDDWSSS-UHFFFAOYSA-N
    InChI:  InChI=1S/C11H19NO2S/c1-11(2,3)14-10(13)12-8-4-5-9(12)7-15-6-8/h8-9H,4-7H2,1-3H3
    Synonyms: 1520084-33-6 | tert-butyl 3-thia-8-azabicyclo[3.2.1]octane-8-carboxylate | MFCD32820480 | 8-Boc-3-thia-8-azabicyclo[3...
  5. Thiomorpholine-2,4-dicarboxylic acid 4-tert-butyl ester
      Grade & Purity: 
    • ≥97%
    Cas Number: 134676-67-8        EC Number: 672-563-6        Compound CID:  2760619
    Formula:  C10H17NO4S        Molecular Weight: 247.31
    IUPAC Name:  4-[(2-methylpropan-2-yl)oxycarbonyl]thiomorpholine-2-carboxylic acid
    SMILES:  CC(C)(C)OC(=O)N1CCSC(C1)C(=O)O
    InChIKey: VJGKMSGPYQNGGK-UHFFFAOYSA-N
    InChI:  InChI=1S/C10H17NO4S/c1-10(2,3)15-9(14)11-4-5-16-7(6-11)8(12)13/h7H,4-6H2,1-3H3,(H,12,13)
    Synonyms: AC-6415 | AMY20589 | Thiomorpholine-2,4-dicarboxylic acid 4-tert-butylester | AS-54695 | SCHEMBL160579 | Thiomorpholi...
  6. Ethyl n-boc-2-thiomorpholinecarboxylate
      Grade & Purity: 
    • ≥95%
    Cas Number: 1346597-50-9
    Formula:  C12H21NO4S        Molecular Weight: 275.4
    IUPAC Name:  4-O-tert-butyl 2-O-ethyl thiomorpholine-2,4-dicarboxylate
    SMILES:  CCOC(=O)C1CN(CCS1)C(=O)OC(C)(C)C
    InChIKey: AULIHHKCGONFAV-UHFFFAOYSA-N
    InChI:  InChI=1S/C12H21NO4S/c1-5-16-10(14)9-8-13(6-7-18-9)11(15)17-12(2,3)4/h9H,5-8H2,1-4H3
    Synonyms: Ethyl N-Boc-2-thiomorpholinecarboxylate|1346597-50-9|4-tert-Butyl 2-ethyl thiomorpholine-2,4-dicarboxylate|MFCD201342...
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