Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Butanoic acid, 4-((7,8-dihydro-7,7-dimethyl-4-(methylamino)-6H-pyrimido(4,5-b)(1,4)benzothiazin-9-yl)amino)-, monohydrobromide
RN: 103291-36-7
InChIKey: PTZGPLOKRZQVEN-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H23-N5-O2-S.Br-H

Molecular Weight

  • 442.3796
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

  • Butanoic acid, 4-((7,8-dihydro-7,7-dimethyl-4-(methylamino)-6H-pyrimido(4,5-b)(1,4)benzothiazin-9-yl)amino)-, monohydrobromide

Registry Numbers

CAS Registry Number

  • 103291-36-7

System Generated Number

  • 0103291367

Molecular Formulas

Molecular Formula

  • C17-H23-N5-O2-S.Br-H

Molecular Formula Fragments

  • Br-H
  • C17-H23-N5-O2-S
  • COMPONENT

Structure Descriptors

InChI

1S/C17H23N5O2S.BrH/c1-17(2)7-10(19-6-4-5-12(23)24)14-11(8-17)22-13-15(18-3)20-9-21-16(13)25-14;/h9,19H,4-8H2,1-3H3,(H,23,24)(H,18,20,21);1H

InChIKey

PTZGPLOKRZQVEN-UHFFFAOYSA-N

Smiles

CC1(CC(=C2C(=Nc3c(ncnc3S2)NC)C1)NCCCC(=O)O)C.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.