S-Methylisothiourea hemisulfate

CAS Registry Number®

867-44-7

CAS Name

S-Methylisothiourea hemisulfate

Molecular Formula

C2H6N2S.1/2H2O4S

Cite this Page

S-Methylisothiourea hemisulfate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=867-44-7 (retrieved 2024-11-21) (CAS RN: 867-44-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    239 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C2H6N2S.H2O4S/c1-5-2(3)4;1-5(2,3)4/h1H3,(H3,3,4);(H2,1,2,3,4)

InChIKey

InChIKey=NNBBQNFHCVVQHZ-UHFFFAOYSA-N

SMILES

S(=O)(=O)(O)O.C(SC)(=N)N

Canonical SMILES

O=S(=O)(O)O.N=C(SC)N

Other Names for this Substance

  • Carbamimidothioic acid, methyl ester, sulfate (2:1)
  • Pseudourea, 2-methyl-2-thio-, sulfate (2:1)
  • S-Methylthiouronium sulfate (2:1)
  • S-Methylisothiourea sulfate (2:1)
  • 2-Methyl-2-thiopseudourea sulfate (2:1)

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Deleted or Replaced CAS Registry Numbers

72046-63-0

CAS INSIGHTSTM
Targeted protein degrader structure, illustration