4-Amino-5-phenyl-4H-1,2,4-triazole-3-thiol

CAS Registry Number®

22706-11-2

CAS Name

4-Amino-5-phenyl-4H-1,2,4-triazole-3-thiol

Molecular Formula

C8H8N4S

Molecular Mass

192.24

Cite this Page

4-Amino-5-phenyl-4H-1,2,4-triazole-3-thiol.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=21089-45-2 (retrieved 2024-11-24) (CAS RN: 22706-11-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    204-205 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C8H8N4S/c9-12-7(10-11-8(12)13)6-4-2-1-3-5-6/h1-5H,9H2,(H,11,13)

InChIKey

InChIKey=OKNHZPGPLNUEPC-UHFFFAOYSA-N

SMILES

NN1C(=NNC1=S)C2=CC=CC=C2

Canonical SMILES

S=C1NN=C(C=2C=CC=CC2)N1N

Other Names for this Substance

  • 3H-1,2,4-Triazole-3-thione, 4-amino-2,4-dihydro-5-phenyl-
  • 4H-1,2,4-Triazole-3-thiol, 4-amino-5-phenyl-
  • 4-Amino-2,4-dihydro-5-phenyl-3H-1,2,4-triazole-3-thione
  • 1H-4-Amino-3-phenyl-s-triazole-5-thione
  • 4-Amino-5-phenyl-4H-1,2,4-triazole-3-thiol

View All

Deleted or Replaced CAS Registry Numbers

21089-45-2, 1353549-58-2

CAS INSIGHTSTM
Hourglass and a clock