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Substance Name: 4H-1-Benzothiopyran-4-one, 2,3-dihydro-3-(1,3-benzodioxol-5-ylmethylene)-6-methoxy-, (Z)-
RN: 130689-05-3
InChIKey: QFBKJAKGMWLZTC-WUXMJOGZSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H14-O4-S

Molecular Weight

  • 326.3706
 
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Names and Synonyms

Synonyms

  • (Z)-2,3-Dihydro-3-(1,3-benzodioxol-5-ylmethylene)-6-methoxy-4H-1-benzothiopyran-4-one
  • BRN 3625959

Systematic Name

  • 4H-1-Benzothiopyran-4-one, 2,3-dihydro-3-(1,3-benzodioxol-5-ylmethylene)-6-methoxy-, (Z)-

Registry Numbers

CAS Registry Number

  • 130689-05-3

System Generated Number

  • 0130689053

Structure Descriptors

InChI

1S/C18H14O4S/c1-20-13-3-5-17-14(8-13)18(19)12(9-23-17)6-11-2-4-15-16(7-11)22-10-21-15/h2-8H,9-10H2,1H3/b12-6+

InChIKey

QFBKJAKGMWLZTC-WUXMJOGZSA-N

Smiles

COc1ccc2c(c1)C(=O)/C(=C/c3ccc4c(c3)OCO4)/CS2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD10 intraperitoneal 248mg/kg (248mg/kg)   Drug and Chemical Toxicology. Vol. 13, Pg. 195, 1990.