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Substance Name: Benzeneacetic acid, 4-(2-(butylthio)-4-oxo-3(4H)-quinazolinyl)-, methyl ester
RN: 102038-00-6
InChIKey: ZOVUASWXNQJZHJ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H22-N2-O3-S

Molecular Weight

  • 382.4818
 
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Names and Synonyms

Synonyms

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

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 102038-00-6

System Generated Number

  • 0102038006

Structure Descriptors

InChI

1S/C21H22N2O3S/c1-3-4-13-27-21-22-18-8-6-5-7-17(18)20(25)23(21)16-11-9-15(10-12-16)14-19(24)26-2/h5-12H,3-4,13-14H2,1-2H3

InChIKey

ZOVUASWXNQJZHJ-UHFFFAOYSA-N

Smiles

CCCCSc1nc2ccccc2c(=O)n1c3ccc(cc3)CC(=O)OC

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.