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Substance Name: Benzeneacetic acid, 4-(2-(methylthio)-4-oxo-3(4H)-quinazolinyl)-, methyl ester
RN: 102037-97-8
InChIKey: ITXMZPQVRYGSBI-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H16-N2-O3-S

Molecular Weight

  • 340.4014
 
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Names and Synonyms

Synonyms

  • Methyl 4-(2-(methylthio)-4-oxo-3(4H)-quinazolinyl)benzeneacetate
  • Methyl 4-(2-methylthio-4(3H)-quinazolon-3-yl)phenylacetate

Systematic Name

  • Benzeneacetic acid, 4-(2-(methylthio)-4-oxo-3(4H)-quinazolinyl)-, methyl ester

Registry Numbers

CAS Registry Number

  • 102037-97-8

System Generated Number

  • 0102037978

Structure Descriptors

InChI

1S/C18H16N2O3S/c1-23-16(21)11-12-7-9-13(10-8-12)20-17(22)14-5-3-4-6-15(14)19-18(20)24-2/h3-10H,11H2,1-2H3

InChIKey

ITXMZPQVRYGSBI-UHFFFAOYSA-N

Smiles

COC(=O)Cc1ccc(cc1)n2c(=O)c3ccccc3nc2SC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 1gm/kg (1000mg/kg)   Journal of the Indian Chemical Society. Vol. 62, Pg. 687, 1985.