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Substance Name: NTA 208
RN: 32527-53-0
InChIKey: SWMPOMJQLSHCRO-UHFFFAOYSA-N

Molecular Formula

  • C16-H20-Cl-N3-O3-S.Cl-H

Molecular Weight

  • 406.332
 
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Names and Synonyms

Results Name

  • NTA 208

Synonyms

  • 5-Chloro-3-(4-(2-hydroxy-2-methylethyl)piperazin-1-yl)carbonylmethyl-2-benzothiazolinone HCl
  • NTA-208

Systematic Name

  • 2-Benzothiazolinone, 5-chloro-3-(4-((2-hydroxy-2-methyl)ethyl)piperazin-1-yl)carbonylmethyl-, hydrochloride

Registry Numbers

CAS Registry Number

  • 32527-53-0

System Generated Number

  • 0032527530

Molecular Formulas

Molecular Formula

  • C16-H20-Cl-N3-O3-S.Cl-H

Molecular Formula Fragments

  • C16-H20-Cl-N3-O3-S
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C16H20ClN3O3S.ClH/c1-11(21)9-18-4-6-19(7-5-18)15(22)10-20-13-8-12(17)2-3-14(13)24-16(20)23;/h2-3,8,11,21H,4-7,9-10H2,1H3;1H

InChIKey

SWMPOMJQLSHCRO-UHFFFAOYSA-N

Smiles

c12n(c(=O)sc1ccc(c2)Cl)CC(N1CC[NH+](C[C@@H](C)O)CC1)=O.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 oral 670mg/kg (670mg/kg) GASTROINTESTINAL: ULCERATION OR BLEEDING FROM STOMACH Arzneimittel-Forschung. Drug Research. Vol. 22, Pg. 711, 1972.