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Substance Name: Acetamide, N-(3-(diethylamino)propyl)-N-(2-nitro-3-thienyl)-, monohydrochloride
RN: 122777-81-5
InChIKey: YESAUUNVFCUTBL-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H21-N3-O3-S.Cl-H

Molecular Weight

  • 335.8538
 
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Names and Synonyms

Synonym

  • N-(3-(Diethylamino)propyl)-N-(2-nitro-3-thienyl)acetamide hydrochloride

Systematic Name

  • Acetamide, N-(3-(diethylamino)propyl)-N-(2-nitro-3-thienyl)-, monohydrochloride

Registry Numbers

CAS Registry Number

  • 122777-81-5

System Generated Number

  • 0122777815

Molecular Formulas

Molecular Formula

  • C13-H21-N3-O3-S.Cl-H

Molecular Formula Fragments

  • C13-H21-N3-O3-S
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C13H21N3O3S.ClH/c1-4-14(5-2)8-6-9-15(11(3)17)12-7-10-20-13(12)16(18)19;/h7,10H,4-6,8-9H2,1-3H3;1H

InChIKey

YESAUUNVFCUTBL-UHFFFAOYSA-N

Smiles

CCN(CC)CCCN(c1ccsc1[N+](=O)[O-])C(=O)C.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 750mg/kg (750mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 23, Pg. 553, 1988.
mouse LD50 oral 1gm/kg (1000mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 23, Pg. 553, 1988.