5-(3-Chlorophenyl)-2,4-dihydro-4-(2-methylpropyl)-3H-1,2,4-triazole-3-thione

CAS Registry Number®

26028-64-8
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CAS Name

5-(3-Chlorophenyl)-2,4-dihydro-4-(2-methylpropyl)-3H-1,2,4-triazole-3-thione

Molecular Formula

C12H14ClN3S

Molecular Mass

267.78

Cite this Page

5-(3-Chlorophenyl)-2,4-dihydro-4-(2-methylpropyl)-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=26028-64-8 (retrieved 2024-04-28) (CAS RN: 26028-64-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C12H14ClN3S/c1-8(2)7-16-11(14-15-12(16)17)9-4-3-5-10(13)6-9/h3-6,8H,7H2,1-2H3,(H,15,17)

InChIKey

InChIKey=NPNVFRBBSDZLNK-UHFFFAOYSA-N

SMILES

C(C(C)C)N1C(=NNC1=S)C2=CC(Cl)=CC=C2

Canonical SMILES

S=C1NN=C(C=2C=CC=C(Cl)C2)N1CC(C)C

Other Names for this Substance

  • 3H-1,2,4-Triazole-3-thione, 5-(3-chlorophenyl)-2,4-dihydro-4-(2-methylpropyl)-
  • 4H-1,2,4-Triazole-3-thiol, 5-(m-chlorophenyl)-4-isobutyl-
  • 5-(3-Chlorophenyl)-2,4-dihydro-4-(2-methylpropyl)-3H-1,2,4-triazole-3-thione

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