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Substance Name: 6H-Pyrimido(4,5-b)(1,4)benzothiazine-4,9-diamine, 7,8-dihydro-7,7-dimethyl-N(sup 9)-hexyl-, monohydrobromide
RN: 103291-29-8
InChIKey: ULOHFXVSRWKDPH-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H27-N5-S.Br-H

Molecular Weight

  • 426.4242
 
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Names and Synonyms

  • 6H-Pyrimido(4,5-b)(1,4)benzothiazine-4,9-diamine, 7,8-dihydro-7,7-dimethyl-N(sup 9)-hexyl-, monohydrobromide

Registry Numbers

CAS Registry Number

  • 103291-29-8

System Generated Number

  • 0103291298

Molecular Formulas

Molecular Formula

  • C18-H27-N5-S.Br-H

Molecular Formula Fragments

  • Br-H
  • C18-H27-N5-S
  • COMPONENT

Structure Descriptors

InChI

1S/C18H27N5S.BrH/c1-4-5-6-7-8-20-16-14-17(22-11-21-16)24-15-12(19)9-18(2,3)10-13(15)23-14;/h11H,4-10,19H2,1-3H3,(H,20,21,22);1H

InChIKey

ULOHFXVSRWKDPH-UHFFFAOYSA-N

Smiles

CCCCCCNc1c2c(ncn1)SC3=C(CC(CC3=N2)(C)C)N.Br

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 500mg/kg (500mg/kg)   Pharmaceutical Chemistry Journal Vol. 19, Pg. 567, 1985.