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Substance Name: Benzeneacetic acid, alpha-methyl-4-(4-oxo-2-((2-oxoheptyl)thio)-3(4H)-quinazolinyl)-, methyl ester
RN: 102038-08-4
InChIKey: GMYINROQILVCSW-UHFFFAOYSA-N

Molecular Formula

  • C25-H28-N2-O4-S

Molecular Weight

  • 452.5722
 
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Names and Synonyms

Synonym

  • Methyl alpha-methyl-4-(4-oxo-2-((2-oxoheptyl)thio)-3(4H)-quinazolinyl)benzeneacetate

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 102038-08-4

System Generated Number

  • 0102038084

Structure Descriptors

InChI

1S/C25H28N2O4S/c1-4-5-6-9-20(28)16-32-25-26-22-11-8-7-10-21(22)23(29)27(25)19-14-12-18(13-15-19)17(2)24(30)31-3/h7-8,10-15,17H,4-6,9,16H2,1-3H3

InChIKey

GMYINROQILVCSW-UHFFFAOYSA-N

Smiles

CCCCCC(=O)CSc1nc2ccccc2c(=O)n1c3ccc(cc3)C(C)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.