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Substance Name: 2-Thiopheneacetic acid, 4-carboxy-5-cinnamamido-3-methyl-
RN: 105522-87-0
InChIKey: YDHHQDSXFVCFLL-BQYQJAHWSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H15-N-O5-S

Molecular Weight

  • 345.3735
 
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Names and Synonyms

Synonyms

  • 2-Thiopheneacetic acid, 4-carboxy-3-methyl-5-((1-oxo-3-phenyl-2-propenyl)amino)-
  • 4-Carboxy-5-cinnamamido-3-methyl-2-thiopheneacetic acid
  • BRN 5616194

Systematic Name

  • 2-Thiopheneacetic acid, 4-carboxy-5-cinnamamido-3-methyl-

Registry Numbers

CAS Registry Number

  • 105522-87-0

System Generated Number

  • 0105522870

Structure Descriptors

InChI

1S/C17H15NO5S/c1-10-12(9-14(20)21)24-16(15(10)17(22)23)18-13(19)8-7-11-5-3-2-4-6-11/h2-8H,9H2,1H3,(H,18,19)(H,20,21)(H,22,23)/b8-7+

InChIKey

YDHHQDSXFVCFLL-BQYQJAHWSA-N

Smiles

Cc1c(sc(c1C(=O)O)NC(=O)/C=C/c2ccccc2)CC(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 1gm/kg (1000mg/kg)   Pharmaceutical Chemistry Journal Vol. 20, Pg. 23, 1986.