4-Amino-5-[(4-chlorophenoxy)methyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione

CAS Registry Number®

4413-43-8

CAS Name

4-Amino-5-[(4-chlorophenoxy)methyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione

Molecular Formula

C9H9ClN4OS

Molecular Mass

256.71

Cite this Page

4-Amino-5-[(4-chlorophenoxy)methyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=4413-43-8 (retrieved 2024-11-24) (CAS RN: 4413-43-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    184-185 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C9H9ClN4OS/c10-6-1-3-7(4-2-6)15-5-8-12-13-9(16)14(8)11/h1-4H,5,11H2,(H,13,16)

InChIKey

InChIKey=VKXMIAZOMPVHIM-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

S=C1NN=C(N1N)COC2=CC=C(Cl)C=C2

Other Names for this Substance

  • 3H-1,2,4-Triazole-3-thione, 4-amino-5-[(4-chlorophenoxy)methyl]-2,4-dihydro-
  • 4H-1,2,4-Triazole-3-thiol, 4-amino-5-[(p-chlorophenoxy)methyl]-
  • 4-Amino-5-[(4-chlorophenoxy)methyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione

Deleted or Replaced CAS Registry Numbers

115630-87-0

CAS INSIGHTSTM
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