4-Amino-2,4-dihydro-5-(phenoxymethyl)-3H-1,2,4-triazole-3-thione

CAS Registry Number®

4461-15-8
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CAS Name

4-Amino-2,4-dihydro-5-(phenoxymethyl)-3H-1,2,4-triazole-3-thione

Molecular Formula

C9H10N4OS

Molecular Mass

222.27

Cite this Page

4-Amino-2,4-dihydro-5-(phenoxymethyl)-3H-1,2,4-triazole-3-thione.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=4461-15-8 (retrieved 2024-04-28) (CAS RN: 4461-15-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    157 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C9H10N4OS/c10-13-8(11-12-9(13)15)6-14-7-4-2-1-3-5-7/h1-5H,6,10H2,(H,12,15)

InChIKey

InChIKey=PKDBJOGLFPYJRY-UHFFFAOYSA-N

SMILES

C(OC1=CC=CC=C1)C=2N(N)C(=S)NN2

Canonical SMILES

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

Other Names for this Substance

  • 3H-1,2,4-Triazole-3-thione, 4-amino-2,4-dihydro-5-(phenoxymethyl)-
  • 4H-1,2,4-Triazole-3-thiol, 4-amino-5-(phenoxymethyl)-
  • 4-Amino-2,4-dihydro-5-(phenoxymethyl)-3H-1,2,4-triazole-3-thione
  • 4-Amino-3-(phenoxymethyl)-5-mercapto-1,2,4-triazole

Deleted or Replaced CAS Registry Numbers

115630-86-9

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