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Substance Name: Benzeneacetic acid, 4-(1,4-dihydro-4-oxo-2-thioxo-3(2H)-quinazolinyl)-alpha-methyl-, methyl ester
RN: 102037-96-7
InChIKey: HLOMZYIUZUJVOT-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-(1,4-dihydro-4-oxo-2-thioxo-3(2H)-quinazolinyl)-alpha-methylbenzeneacetate
  • Methyl 4-(2-mercapto-4(3H)-quinazolon-3-yl)phenylpropionate

Systematic Name

  • Benzeneacetic acid, 4-(1,4-dihydro-4-oxo-2-thioxo-3(2H)-quinazolinyl)-alpha-methyl-, methyl ester

Registry Numbers

CAS Registry Number

  • 102037-96-7

System Generated Number

  • 0102037967

Structure Descriptors

InChI

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

InChIKey

HLOMZYIUZUJVOT-UHFFFAOYSA-N

Smiles

CC(c1ccc(cc1)n2c(=O)c3ccccc3[nH]c2=S)C(=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.