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Substance Name: Hexadecanoic acid, 2-methyl-3-((2-pyridinylamino)carbonyl)-2H-thieno(2,3-e)-1,2-thiazin-4-yl ester, S,S-dioxide
RN: 123253-05-4
InChIKey: YWIXVCULZRFYEG-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C29-H41-N3-O5-S2

Molecular Weight

  • 575.7909
 
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Names and Synonyms

  • Hexadecanoic acid, 2-methyl-3-((2-pyridinylamino)carbonyl)-2H-thieno(2,3-e)-1,2-thiazin-4-yl ester, S,S-dioxide

Registry Numbers

CAS Registry Number

  • 123253-05-4

System Generated Number

  • 0123253054

Structure Descriptors

InChI

1S/C29H41N3O5S2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-19-25(33)37-27-26(29(34)31-24-18-16-17-21-30-24)32(2)39(35,36)23-20-22-38-28(23)27/h16-18,20-22H,3-15,19H2,1-2H3,(H,30,31,34)

InChIKey

YWIXVCULZRFYEG-UHFFFAOYSA-N

Smiles

CCCCCCCCCCCCCCCC(=O)OC1=C(N(S(=O)(=O)c2c1scc2)C)C(=O)Nc3ccccn3

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 oral > 30mg/kg (30mg/kg)   Nippon Yakurigaku Zasshi. Japanese Journal of Pharmacology. Vol. 94, Pg. 61, 1989.