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Substance Name: 1,2-Benzenediol, 4-((2-(2-(methylamino)propyl)phenyl)thio)-
RN: 128959-11-5
InChIKey: ILLAPBZUXFDMBV-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H19-N-O2-S

Molecular Weight

  • 289.3971
 
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Names and Synonyms

Synonyms

  • 4-((2-(2-(Methylamino)propyl)phenyl)thio)-1,2-benzenediol
  • BRN 3653971

Systematic Name

  • 1,2-Benzenediol, 4-((2-(2-(methylamino)propyl)phenyl)thio)-

Registry Numbers

CAS Registry Number

  • 128959-11-5

System Generated Number

  • 0128959115

Structure Descriptors

InChI

1S/C16H19NO2S/c1-11(17-2)9-12-5-3-4-6-16(12)20-13-7-8-14(18)15(19)10-13/h3-8,10-11,17-19H,9H2,1-2H3

InChIKey

ILLAPBZUXFDMBV-UHFFFAOYSA-N

Smiles

CC(Cc1ccccc1Sc2ccc(c(c2)O)O)NC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 529mg/kg (529mg/kg)   Collection of Czechoslovak Chemical Communications. Vol. 55, Pg. 1077, 1990.