5-[(4-Chlorophenyl)methyl]-1,3,4-oxadiazole-2(3H)-thione

CAS Registry Number®

93073-38-2
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CAS Name

5-[(4-Chlorophenyl)methyl]-1,3,4-oxadiazole-2(3H)-thione

Molecular Formula

C9H7ClN2OS

Molecular Mass

226.68

Cite this Page

5-[(4-Chlorophenyl)methyl]-1,3,4-oxadiazole-2(3H)-thione.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=93073-38-2 (retrieved 2024-09-08) (CAS RN: 93073-38-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    101-103 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C9H7ClN2OS/c10-7-3-1-6(2-4-7)5-8-11-12-9(14)13-8/h1-4H,5H2,(H,12,14)

InChIKey

InChIKey=LOBIRZKDPDHUGL-UHFFFAOYSA-N

SMILES

C(C=1OC(=S)NN1)C2=CC=C(Cl)C=C2

Canonical SMILES

S=C1OC(=NN1)CC2=CC=C(Cl)C=C2

Other Names for this Substance

  • 1,3,4-Oxadiazole-2(3H)-thione, 5-[(4-chlorophenyl)methyl]-
  • 5-[(4-Chlorophenyl)methyl]-1,3,4-oxadiazole-2(3H)-thione
  • 2-Mercapto-5-(4-chlorobenzyl)-1,3,4-oxadiazole