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Substance Name: 5H-(1)Benzothiopyrano(4,3-b)pyridine-3-carbonitrile, 2-methoxy-4-(2-methoxyphenyl)-
RN: 115091-85-5
InChIKey: TVZCIJMTTFPRSI-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H16-N2-O2-S

Molecular Weight

  • 360.4354
 
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Names and Synonyms

Synonyms

  • 2-Methoxy-4-(2-methoxyphenyl)-5H-(1)benzothiopyrano(4,3-b)pyridine-3-carbonitrile
  • BRN 4272508

Systematic Name

  • 5H-(1)Benzothiopyrano(4,3-b)pyridine-3-carbonitrile, 2-methoxy-4-(2-methoxyphenyl)-

Registry Numbers

CAS Registry Number

  • 115091-85-5

System Generated Number

  • 0115091855

Structure Descriptors

InChI

1S/C21H16N2O2S/c1-24-17-9-5-3-7-13(17)19-15(11-22)21(25-2)23-20-14-8-4-6-10-18(14)26-12-16(19)20/h3-10H,12H2,1-2H3

InChIKey

TVZCIJMTTFPRSI-UHFFFAOYSA-N

Smiles

COc1ccccc1c2c3c(nc(c2C#N)OC)-c4ccccc4SC3

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 230mg/kg (230mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 26, Pg. 221, 1991.