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Substance Name: Acetamide, 2-chloro-N-(5,6,7,9-tetrahydro-1,2,3-trimethoxy-10-(methylthio)-9-oxobenzo(a)heptalen-7-yl)-, (S)-
RN: 38479-08-2
InChIKey: WRQYTVSIGKEZEJ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H24-Cl-N-O5-S

Molecular Weight

  • 449.9526
 
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Names and Synonyms

Synonyms

  • 17-Chloro-10-demethoxy-10-methylthiocolchicine
  • BRN 2790213
  • NSC 261044

Systematic Name

  • Acetamide, 2-chloro-N-(5,6,7,9-tetrahydro-1,2,3-trimethoxy-10-(methylthio)-9-oxobenzo(a)heptalen-7-yl)-, (S)-

Registry Numbers

CAS Registry Number

  • 38479-08-2

System Generated Number

  • 0038479082

Structure Descriptors

InChI

1S/C22H24ClNO5S/c1-27-17-9-12-5-7-15(24-19(26)11-23)14-10-16(25)18(30-4)8-6-13(14)20(12)22(29-3)21(17)28-2/h6,8-10,15H,5,7,11H2,1-4H3,(H,24,26)

InChIKey

WRQYTVSIGKEZEJ-UHFFFAOYSA-N

Smiles

COc1cc2CCC(NC(=O)CCl)C3=CC(=O)C(=CC=C3c2c(OC)c1OC)SC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 1007ug/kg (1.007mg/kg)   Journal of Medicinal Chemistry. Vol. 24, Pg. 636, 1981.