2-[[5-(2-Fluorophenyl)-4-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]thio]acetic acid

CAS Registry Number®

733031-05-5

CAS Name

2-[[5-(2-Fluorophenyl)-4-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]thio]acetic acid

Molecular Formula

C16H11F2N3O2S

Molecular Mass

347.34

Cite this Page

2-[[5-(2-Fluorophenyl)-4-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]thio]acetic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=733031-05-5 (retrieved 2024-11-26) (CAS RN: 733031-05-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C16H11F2N3O2S/c17-10-5-7-11(8-6-10)21-15(12-3-1-2-4-13(12)18)19-20-16(21)24-9-14(22)23/h1-8H,9H2,(H,22,23)

InChIKey

InChIKey=QJNLVEQHAPFSMY-UHFFFAOYSA-N

SMILES

S(CC(O)=O)C=1N(C(=NN1)C2=C(F)C=CC=C2)C3=CC=C(F)C=C3

Canonical SMILES

O=C(O)CSC1=NN=C(C=2C=CC=CC2F)N1C3=CC=C(F)C=C3

Other Names for this Substance

  • Acetic acid, 2-[[5-(2-fluorophenyl)-4-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]thio]-
  • Acetic acid, [[5-(2-fluorophenyl)-4-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]thio]-
  • 2-[[5-(2-Fluorophenyl)-4-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]thio]acetic acid

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