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Substance Name: 1H-Indole-3-carboxylic acid, 5-((diethylamino)sulfonyl)-
RN: 120729-94-4
InChIKey: VUTQTXIJKGTCHG-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H16-N2-O4-S

Molecular Weight

  • 296.3454
 
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Names and Synonyms

Synonyms

  • 5-((Diethylamino)sulfonyl)-1H-indole-3-carboxylic acid
  • BRN 3561051

Systematic Name

  • 1H-Indole-3-carboxylic acid, 5-((diethylamino)sulfonyl)-

Registry Numbers

CAS Registry Number

  • 120729-94-4

System Generated Number

  • 0120729944

Structure Descriptors

InChI

1S/C13H16N2O4S/c1-3-15(4-2)20(18,19)9-5-6-12-10(7-9)11(8-14-12)13(16)17/h5-8,14H,3-4H2,1-2H3,(H,16,17)

InChIKey

VUTQTXIJKGTCHG-UHFFFAOYSA-N

Smiles

CCN(CC)S(=O)(=O)c1ccc2c(c1)c(c[nH]2)C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo intraperitoneal 3gm/kg (3000mg/kg)   Pharmaceutical Chemistry Journal Vol. 23, Pg. 126, 1989.