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Substance Name: Butanoic acid, 3-mercapto-3-methyl-2-((1-methyl-2-piperadinylidene)amino)-
RN: 105099-13-6
InChIKey: RDXLHBBYFPNXNP-YXYQAXARSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C11-H20-N2-O2-S

Molecular Weight

  • 244.357
 
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Names and Synonyms

Synonyms

  • 3-Mercapto-3-methyl-2-((1-methyl-2-piperidinylidene)amino)butanoic acid
  • BRN 5528811

Systematic Name

  • Butanoic acid, 3-mercapto-3-methyl-2-((1-methyl-2-piperadinylidene)amino)-

Registry Numbers

CAS Registry Number

  • 105099-13-6

System Generated Number

  • 0105099136

Structure Descriptors

InChI

1S/C11H20N2O2S/c1-11(2,16)9(10(14)15)12-8-6-4-5-7-13(8)3/h9,16H,4-7H2,1-3H3,(H,14,15)/b12-8+/t9-/m1/s1

InChIKey

RDXLHBBYFPNXNP-YXYQAXARSA-N

Smiles

CC(C)([C@@H](C(=O)O)/N=C/1\CCCCN1C)S

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 1gm/kg (1000mg/kg)   Pharmaceutical Chemistry Journal Vol. 21, Pg. 842, 1987.