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Substance Name: Benzeneacetic acid, alpha-((4-(4-methoxyphenyl)-6-methyl-2-pyrimidinyl)thio)-
RN: 87125-99-3
InChIKey: OAPBYYJLNHQZCG-UHFFFAOYSA-N

Classification Codes

  • Agricultural Chemical
  • Nematocide

Molecular Formula

  • C20-H18-N2-O3-S

Molecular Weight

  • 366.4392
 
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Names and Synonyms

Synonyms

  • 2-Pyrimidinethioacetic acid, 4-(4-methoxyphenyl)-6-methyl-beta-phenyl
  • alpha-((4-(4-Methoxyphenyl)-6-methyl-2-pyrimidinyl)thio)benzeneacetic acid
  • BRN 4555202

Systematic Name

  • Benzeneacetic acid, alpha-((4-(4-methoxyphenyl)-6-methyl-2-pyrimidinyl)thio)-

Registry Numbers

CAS Registry Number

  • 87125-99-3

System Generated Number

  • 0087125993

Structure Descriptors

InChI

1S/C20H18N2O3S/c1-13-12-17(14-8-10-16(25-2)11-9-14)22-20(21-13)26-18(19(23)24)15-6-4-3-5-7-15/h3-12,18H,1-2H3,(H,23,24)

InChIKey

OAPBYYJLNHQZCG-UHFFFAOYSA-N

Smiles

Cc1cc(nc(n1)SC(c2ccccc2)C(=O)O)c3ccc(cc3)OC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intramuscular > 500mg/kg (500mg/kg)   Fiziologicheski Aktivnye Veshchestva. Physiologically Active Substances. Vol. 18, Pg. 75, 1986.