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Substance Name: Benzeneacetic acid, 4-(4-oxo-2-((phenylmethyl)thio)-3(4H)-quinazolinyl)-, methyl ester
RN: 102038-01-7
InChIKey: WLRQHEZBYSYMQK-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C24-H20-N2-O3-S

Molecular Weight

  • 416.499
 
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Names and Synonyms

Synonyms

  • Methyl 4-(2-benzylthio-4(3H)-quinazolon-3-yl)phenylacetate
  • Methyl 4-(4-oxo-2-((phenylmethyl)thio)-3(4H)-quinazolinyl)benzeneacetate

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 102038-01-7

System Generated Number

  • 0102038017

Structure Descriptors

InChI

1S/C24H20N2O3S/c1-29-22(27)15-17-11-13-19(14-12-17)26-23(28)20-9-5-6-10-21(20)25-24(26)30-16-18-7-3-2-4-8-18/h2-14H,15-16H2,1H3

InChIKey

WLRQHEZBYSYMQK-UHFFFAOYSA-N

Smiles

COC(=O)Cc1ccc(cc1)n2c(=O)c3ccccc3nc2SCc4ccccc4

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.