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Substance Name: Pyrido(2,3-d)pyrimidine-5-carboxylic acid, 3,4-dihydro-3,7-dimethyl-4-oxo-2-(2-propenylthio)-,ethyl ester
RN: 126596-45-0
InChIKey: BLEBCMJGSNWUPW-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H17-N3-O3-S

Molecular Weight

  • 319.3833
 
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Names and Synonyms

Synonym

  • BRN 3560700

Systematic Name

  • Pyrido(2,3-d)pyrimidine-5-carboxylic acid, 3,4-dihydro-3,7-dimethyl-4-oxo-2-(2-propenylthio)-,ethyl ester

Registry Numbers

CAS Registry Number

  • 126596-45-0

System Generated Number

  • 0126596450

Structure Descriptors

InChI

1S/C15H17N3O3S/c1-5-7-22-15-17-12-11(13(19)18(15)4)10(8-9(3)16-12)14(20)21-6-2/h5,8H,1,6-7H2,2-4H3

InChIKey

BLEBCMJGSNWUPW-UHFFFAOYSA-N

Smiles

CCOC(=O)c1cc(nc2c1c(=O)n(c(n2)SCC=C)C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mammal (species unspecified) LD50 intraperitoneal 989mg/kg (989mg/kg)   Farmaco. Vol. 45, Pg. 111, 1990.