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Substance Name: Malonic acid, 2-acetamido-2-((4,4-dimethyl-4H-1,3-benzothiazin-2-yl)methyl)-, diethyl ester
RN: 101809-61-4
InChIKey: RSOUUILAPWMSFZ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H26-N2-O5-S

Molecular Weight

  • 406.5
 
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Names and Synonyms

Synonym

  • 2-Acetamido-2-((4,4-dimethyl-4H-1,3-benzothiazin-2-yl)methyl)malonic acid diethyl ester

Systematic Name

  • Malonic acid, 2-acetamido-2-((4,4-dimethyl-4H-1,3-benzothiazin-2-yl)methyl)-, diethyl ester

Registry Numbers

CAS Registry Number

  • 101809-61-4

System Generated Number

  • 0101809614

Structure Descriptors

InChI

1S/C20H26N2O5S/c1-6-26-17(24)20(21-13(3)23,18(25)27-7-2)12-16-22-19(4,5)14-10-8-9-11-15(14)28-16/h8-11H,6-7,12H2,1-5H3,(H,21,23)

InChIKey

RSOUUILAPWMSFZ-UHFFFAOYSA-N

Smiles

C(CC=1Sc2c(cccc2)C(N1)(C)C)(C(OCC)=O)(C(OCC)=O)NC(C)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 400mg/kg (400mg/kg) BEHAVIORAL: CHANGES IN MOTOR ACTIVITY (SPECIFIC ASSAY)

BRAIN AND COVERINGS: RECORDINGS FROM SPECIFIC AREAS OF CNS
Russian Pharmacology and Toxicology Vol. 45, Pg. 64, 1982.