1-[(2,4,6-Trimethylphenyl)sulfonyl]-1H-1,2,4-triazole

CAS Registry Number®

54230-59-0
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CAS Name

1-[(2,4,6-Trimethylphenyl)sulfonyl]-1H-1,2,4-triazole

Molecular Formula

C11H13N3O2S

Molecular Mass

251.30

Cite this Page

1-[(2,4,6-Trimethylphenyl)sulfonyl]-1H-1,2,4-triazole.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=54230-59-0 (retrieved 2024-04-28) (CAS RN: 54230-59-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C11H13N3O2S/c1-8-4-9(2)11(10(3)5-8)17(15,16)14-7-12-6-13-14/h4-7H,1-3H3

InChIKey

InChIKey=XNKYPZJMRHXJJQ-UHFFFAOYSA-N

SMILES

S(=O)(=O)(C1=C(C)C=C(C)C=C1C)N2C=NC=N2

Canonical SMILES

O=S(=O)(C=1C(=CC(=CC1C)C)C)N2N=CN=C2

Other Names for this Substance

  • 1H-1,2,4-Triazole, 1-[(2,4,6-trimethylphenyl)sulfonyl]-
  • 1-[(2,4,6-Trimethylphenyl)sulfonyl]-1H-1,2,4-triazole
  • 1-(2,4,6-Trimethylphenyl)sulfonyl-1,2,4-triazole
  • 1-(Mesitylsulfonyl)-1H-1,2,4-triazole
  • 1-(Mesitylen-2-sulfonyl)-1H-1,2,4-triazole

Deleted or Replaced CAS Registry Numbers

76512-90-8

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