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

CAS Registry Number®

537017-41-7
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CAS Name

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

Molecular Formula

C17H13Cl2N3O2S

Molecular Mass

394.27

Cite this Page

2-[[5-(2,4-Dichlorophenyl)-4-(phenylmethyl)-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=537017-41-7 (retrieved 2024-08-06) (CAS RN: 537017-41-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C17H13Cl2N3O2S/c18-12-6-7-13(14(19)8-12)16-20-21-17(25-10-15(23)24)22(16)9-11-4-2-1-3-5-11/h1-8H,9-10H2,(H,23,24)

InChIKey

InChIKey=GXICCEULDLRBQT-UHFFFAOYSA-N

SMILES

C(N1C(=NN=C1SCC(O)=O)C2=C(Cl)C=C(Cl)C=C2)C3=CC=CC=C3

Canonical SMILES

O=C(O)CSC1=NN=C(C=2C=CC(Cl)=CC2Cl)N1CC=3C=CC=CC3

Other Names for this Substance

  • Acetic acid, 2-[[5-(2,4-dichlorophenyl)-4-(phenylmethyl)-4H-1,2,4-triazol-3-yl]thio]-
  • Acetic acid, [[5-(2,4-dichlorophenyl)-4-(phenylmethyl)-4H-1,2,4-triazol-3-yl]thio]-
  • 2-[[5-(2,4-Dichlorophenyl)-4-(phenylmethyl)-4H-1,2,4-triazol-3-yl]thio]acetic acid