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Substance Name: 3-Thiophenamine, N-butyl-2-nitro-
RN: 122777-61-1
InChIKey: ZKVRCOIETBFZSW-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C8-H12-N2-O2-S

Molecular Weight

  • 200.2608
 
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Names and Synonyms

Synonyms

  • BRN 5935967
  • N-Butyl-2-nitro-3-thiophenamine

Systematic Name

  • 3-Thiophenamine, N-butyl-2-nitro-

Registry Numbers

CAS Registry Number

  • 122777-61-1

System Generated Number

  • 0122777611

Structure Descriptors

InChI

1S/C8H12N2O2S/c1-2-3-5-9-7-4-6-13-8(7)10(11)12/h4,6,9H,2-3,5H2,1H3

InChIKey

ZKVRCOIETBFZSW-UHFFFAOYSA-N

Smiles

CCCCNc1ccsc1[N+](=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 500mg/kg (500mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 23, Pg. 553, 1988.
mouse LD50 oral 750mg/kg (750mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 23, Pg. 553, 1988.