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Substance Name: 3H-Pyridazino(4,5-b)(1,4)benzothiazin-4(10H)-one, 10-(2-(4-morpholinyl)ethyl)-, N,5,5-trioxide, hydrochloride, hydrate (2:2:1)
RN: 157023-93-3
InChIKey: VFCAWAKJLTUFNS-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H18-N4-O5-S.Cl-H.1/2H2-O

Molecular Weight

  • 414.8681
 
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Names and Synonyms

  • 3H-Pyridazino(4,5-b)(1,4)benzothiazin-4(10H)-one, 10-(2-(4-morpholinyl)ethyl)-, N,5,5-trioxide, hydrochloride, hydrate (2:2:1)

Registry Numbers

CAS Registry Number

  • 157023-93-3

System Generated Number

  • 0157023933

Molecular Formulas

Molecular Formula

  • C16-H18-N4-O5-S.Cl-H.1/2H2-O

Molecular Formula Fragments

  • C16-H18-N4-O5-S
  • Cl-H
  • COMPONENT
  • H2-O

Structure Descriptors

InChI

1S/C16H18N4O5S.ClH/c21-16-15-13(11-17-18-16)19(5-6-20(22)7-9-25-10-8-20)12-3-1-2-4-14(12)26(15,23)24;/h1-4,11H,5-10H2,(H,18,21);1H

InChIKey

VFCAWAKJLTUFNS-UHFFFAOYSA-N

Smiles

c1ccc2c(c1)N(c3cn[nH]c(=O)c3S2(=O)=O)CCN4(=O)CCOCC4.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 500mg/kg (500mg/kg)   Farmaco. Vol. 49, Pg. 237, 1994.
mouse LD50 oral 1gm/kg (1000mg/kg)   Farmaco. Vol. 49, Pg. 237, 1994.