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Substance Name: Acetamide, N-(4-(((imino((imino((5-(4-nitrophenyl)-1,3,4-thiadiazol-2-yl)amino)methyl)amino)methyl)amino)sulfonyl)-2-methylphenyl)-, monohydrochloride
RN: 109193-29-5
InChIKey: WKCSBDADBONSRE-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H19-N9-O5-S2.Cl-H

Molecular Weight

  • 554.01
 
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Names and Synonyms

  • Acetamide, N-(4-(((imino((imino((5-(4-nitrophenyl)-1,3,4-thiadiazol-2-yl)amino)methyl)amino)methyl)amino)sulfonyl)-2-methylphenyl)-, monohydrochloride

Registry Numbers

CAS Registry Number

  • 109193-29-5

System Generated Number

  • 0109193295

Molecular Formulas

Molecular Formula

  • C19-H19-N9-O5-S2.Cl-H

Molecular Formula Fragments

  • C19-H19-N9-O5-S2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C19H19N9O5S2.ClH/c1-10-9-14(7-8-15(10)22-11(2)29)35(32,33)27-18(21)23-17(20)24-19-26-25-16(34-19)12-3-5-13(6-4-12)28(30)31;/h3-9H,1-2H3,(H,22,29)(H5,20,21,23,24,26,27);1H

InChIKey

WKCSBDADBONSRE-UHFFFAOYSA-N

Smiles

Cc1cc(ccc1NC(=O)C)S(=O)(=O)NC(=N)NC(=N)Nc2nnc(s2)c3ccc(cc3)[N+](=O)[O-].Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 800mg/kg (800mg/kg)   Indian Drugs. Vol. 24, Pg. 92, 1986.
mouse LD50 oral > 2gm/kg (2000mg/kg)   Indian Drugs. Vol. 24, Pg. 92, 1986.