5-Amino-1-(phenylmethyl)-1H-1,2,3-triazole-4-carbothioamide

CAS Registry Number®

20271-34-5
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CAS Name

5-Amino-1-(phenylmethyl)-1H-1,2,3-triazole-4-carbothioamide

Molecular Formula

C10H11N5S

Molecular Mass

233.29

Cite this Page

5-Amino-1-(phenylmethyl)-1H-1,2,3-triazole-4-carbothioamide.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=20271-34-5 (retrieved 2024-09-06) (CAS RN: 20271-34-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    227-229 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C10H11N5S/c11-9-8(10(12)16)13-14-15(9)6-7-4-2-1-3-5-7/h1-5H,6,11H2,(H2,12,16)

InChIKey

InChIKey=XQTIYEPLNKHOQF-UHFFFAOYSA-N

SMILES

C(N1C(N)=C(C(N)=S)N=N1)C2=CC=CC=C2

Canonical SMILES

S=C(N)C=1N=NN(C1N)CC=2C=CC=CC2

Other Names for this Substance

  • 1H-1,2,3-Triazole-4-carbothioamide, 5-amino-1-(phenylmethyl)-
  • 1H-1,2,3-Triazole-4-carboxamide, 5-amino-1-benzylthio-
  • 5-Amino-1-(phenylmethyl)-1H-1,2,3-triazole-4-carbothioamide
  • 1-Benzo-5-amino-1,2,3-triazole-4-thiocarboxamide
  • NSC 111591