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Substance Name: 5-Benzothiazoleacetic acid, alpha-methyl-2-phenyl-
RN: 52321-65-0
InChIKey: XCGOOGLJHMKVRE-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H13-N-O2-S

Molecular Weight

  • 283.35
 
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Names and Synonyms

Synonyms

  • 2-Phenyl-5-benzothiazole-alpha-methylacetic acid
  • BRN 0808984
  • NSC 302076

Systematic Name

  • 5-Benzothiazoleacetic acid, alpha-methyl-2-phenyl-

Registry Numbers

CAS Registry Number

  • 52321-65-0

System Generated Number

  • 0052321650

Structure Descriptors

InChI

1S/C16H13NO2S/c1-10(16(18)19)12-7-8-14-13(9-12)17-15(20-14)11-5-3-2-4-6-11/h2-10H,1H3,(H,18,19)

InChIKey

XCGOOGLJHMKVRE-UHFFFAOYSA-N

Smiles

c12c(sc(n1)c1ccccc1)ccc(c2)[C@@H](C(O)=O)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 1500mg/kg (1500mg/kg)   Journal of Medicinal Chemistry. Vol. 17, Pg. 491, 1974.