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Substance Name: Acetic acid, ((5-chloro-2-(((4,5-dihydro-4-methyl-1H-imidazol-2-yl)amino)sulfonyl)-4-methylphenyl)thio)-, compd. with 2,6-dimethylpiperidine (1:1)
RN: 107464-71-1
InChIKey: KNWUJLKOGSZHQQ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H16-Cl-N3-O4-S2.C7-H15-N

Molecular Weight

  • 491.0739
 
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Names and Synonyms

  • Acetic acid, ((5-chloro-2-(((4,5-dihydro-4-methyl-1H-imidazol-2-yl)amino)sulfonyl)-4-methylphenyl)thio)-, compd. with 2,6-dimethylpiperidine (1:1)

Registry Numbers

CAS Registry Number

  • 107464-71-1

System Generated Number

  • 0107464711

Molecular Formulas

Molecular Formula

  • C13-H16-Cl-N3-O4-S2.C7-H15-N

Molecular Formula Fragments

  • C13-H16-Cl-N3-O4-S2
  • C7-H15-N
  • COMPONENT

Structure Descriptors

InChI

1S/C13H16ClN3O4S2.C7H15N/c1-7-3-11(10(4-9(7)14)22-6-12(18)19)23(20,21)17-13-15-5-8(2)16-13;1-6-4-3-5-7(2)8-6/h3-4,8H,5-6H2,1-2H3,(H,18,19)(H2,15,16,17);6-8H,3-5H2,1-2H3

InChIKey

KNWUJLKOGSZHQQ-UHFFFAOYSA-N

Smiles

Cc1cc(c(cc1Cl)SCC(=O)O)S(=O)(=O)NC2=NC(CN2)C.CC1CCCC(N1)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 240mg/kg (240mg/kg)   Acta Poloniae Pharmaceutica. For English translation, see APPFAR. Vol. 42, Pg. 501, 1985.