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Substance Name: 2-Piperazinone, 1-((4,4-dimethyl-4H-1,3-benzothiazin-2-yl)methyl)-3-phenyl-, oxalate
RN: 81735-48-0
InChIKey: NHNZEOPXABIHKI-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H23-N3-O-S.C2-H2-O4

Molecular Weight

  • 455.5325
 
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Names and Synonyms

Synonyms

  • 1-((4,4-Dimethyl-4H-1,3-benzothiazin-2-yl)methyl)-3-phenyl-2-piperazinone oxalate
  • 2-(2'-Oxo-3'-phenylpiperazino)methyl-4,4-dimethyl-4H-1,3-benzothiazine oxalate

Systematic Name

  • 2-Piperazinone, 1-((4,4-dimethyl-4H-1,3-benzothiazin-2-yl)methyl)-3-phenyl-, oxalate

Registry Numbers

CAS Registry Number

  • 81735-48-0

System Generated Number

  • 0081735480

Molecular Formulas

Molecular Formula

  • C21-H23-N3-O-S.C2-H2-O4

Molecular Formula Fragments

  • C2-H2-O4
  • C21-H23-N3-O-S
  • COMPONENT

Structure Descriptors

InChI

1S/C21H23N3OS.C2H2O4/c1-21(2)16-10-6-7-11-17(16)26-18(23-21)14-24-13-12-22-19(20(24)25)15-8-4-3-5-9-15;3-1(4)2(5)6/h3-11,19,22H,12-14H2,1-2H3;(H,3,4)(H,5,6)

InChIKey

NHNZEOPXABIHKI-UHFFFAOYSA-N

Smiles

CC1(c2ccccc2SC(=N1)CN3CCNC(C3=O)c4ccccc4)C.C(=O)(C(=O)O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 300mg/kg (300mg/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.