3-Amino-4-[(1-methylethyl)sulfonyl]-5-(methylthio)-2-thiophenecarboxylic acid

CAS Registry Number®

175202-08-1
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CAS Name

3-Amino-4-[(1-methylethyl)sulfonyl]-5-(methylthio)-2-thiophenecarboxylic acid

Molecular Formula

C9H13NO4S3

Molecular Mass

295.40

Cite this Page

3-Amino-4-[(1-methylethyl)sulfonyl]-5-(methylthio)-2-thiophenecarboxylic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=175202-08-1 (retrieved 2024-05-20) (CAS RN: 175202-08-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C9H13NO4S3/c1-4(2)17(13,14)7-5(10)6(8(11)12)16-9(7)15-3/h4H,10H2,1-3H3,(H,11,12)

InChIKey

InChIKey=CBSGDFVNKZTRRJ-UHFFFAOYSA-N

SMILES

S(C(C)C)(=O)(=O)C1=C(SC)SC(C(O)=O)=C1N

Canonical SMILES

O=C(O)C=1SC(SC)=C(C1N)S(=O)(=O)C(C)C

Other Names for this Substance

  • 2-Thiophenecarboxylic acid, 3-amino-4-[(1-methylethyl)sulfonyl]-5-(methylthio)-
  • 3-Amino-4-[(1-methylethyl)sulfonyl]-5-(methylthio)-2-thiophenecarboxylic acid
  • 3-Amino-4-(isopropylsulfonyl)-5-(methylthio)thiophene-2-carboxylic acid

Deleted or Replaced CAS Registry Numbers

665053-98-5

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