S-(1-Phenyl-1H-tetrazol-5-yl) 4-methylbenzenesulfonothioate

CAS Registry Number®

50623-01-3

CAS Name

S-(1-Phenyl-1H-tetrazol-5-yl) 4-methylbenzenesulfonothioate

Molecular Formula

C14H12N4O2S2

Molecular Mass

332.40

Cite this Page

S-(1-Phenyl-1H-tetrazol-5-yl) 4-methylbenzenesulfonothioate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=50623-01-3 (retrieved 2025-01-03) (CAS RN: 50623-01-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C14H12N4O2S2/c1-11-7-9-13(10-8-11)22(19,20)21-14-15-16-17-18(14)12-5-3-2-4-6-12/h2-10H,1H3

InChIKey

InChIKey=HWMPKARRBLRUAN-UHFFFAOYSA-N

SMILES

S(S(=O)(=O)C1=CC=C(C)C=C1)C=2N(N=NN2)C3=CC=CC=C3

Canonical SMILES

O=S(=O)(SC1=NN=NN1C=2C=CC=CC2)C3=CC=C(C=C3)C

Other Names for this Substance

  • Benzenesulfonothioic acid, 4-methyl-, S-(1-phenyl-1H-tetrazol-5-yl) ester
  • p-Toluenesulfonic acid, thio-, S-1-phenyl-1H-tetrazol-5-yl ester
  • S-(1-Phenyl-1H-tetrazol-5-yl) 4-methylbenzenesulfonothioate
  • NSC 297594

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