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Substance Name: Sydnone imine, N-(((4-aminophenyl)amino)carbonyl)-3-(1-methyl-2-phenylethyl)-, dihydrochloride
RN: 117015-71-1
InChIKey: QMBPYEPKOWZQNS-UHFFFAOYSA-N

Molecular Formula

  • C18-H19-N5-O2.2Cl-H

Molecular Weight

  • 410.3029
 
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Names and Synonyms

Synonyms

  • N(sup 6)-(4-Aminophenyl)carbamoyl-3-phenylisopropylsydnone imine
  • N-((p-Aminophenyl)carbamoyl)-3-(alpha-methylphenethyl)sidnone imine dihydrochloride

Systematic Name

  • Sydnone imine, N-(((4-aminophenyl)amino)carbonyl)-3-(1-methyl-2-phenylethyl)-, dihydrochloride

Registry Numbers

CAS Registry Number

  • 117015-71-1

System Generated Number

  • 0117015711

Molecular Formulas

Molecular Formula

  • C18-H19-N5-O2.2Cl-H

Molecular Formula Fragments

  • C18-H19-N5-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C18H19N5O2.2ClH/c1-13(11-14-5-3-2-4-6-14)23-12-17(25-22-23)21-18(24)20-16-9-7-15(19)8-10-16;;/h2-10,12-13,19,22H,11H2,1H3,(H,21,24);2*1H

InChIKey

QMBPYEPKOWZQNS-UHFFFAOYSA-N

Smiles

CC(Cc1ccccc1)[n+]2cc(on2)NC(=O)Nc3ccc(cc3)N.Cl.[Cl-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 1gm/kg (1000mg/kg)   Khimiko-Farmatsevticheskii Zhurnal. Chemical Pharmaceutical Journal. For English translation, see PCJOAU. Vol. 21, Pg. 1305, 1987.