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Substance Name: 1H-Pyrrole-3-carboxylic acid, 2,5-dihydro-1-(1-methylethyl)-5-oxo-4-((4-(phenylthio)phenyl)amino)-, ethyl ester
RN: 77711-88-7
InChIKey: MWVOGGOTSMCWDD-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H24-N2-O3-S

Molecular Weight

  • 396.5086
 
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Names and Synonyms

Synonym

  • BRN 5154189

Systematic Name

  • 1H-Pyrrole-3-carboxylic acid, 2,5-dihydro-1-(1-methylethyl)-5-oxo-4-((4-(phenylthio)phenyl)amino)-, ethyl ester

Registry Numbers

CAS Registry Number

  • 77711-88-7

System Generated Number

  • 0077711887

Structure Descriptors

InChI

1S/C22H24N2O3S/c1-4-27-22(26)19-14-24(15(2)3)21(25)20(19)23-16-10-12-18(13-11-16)28-17-8-6-5-7-9-17/h5-13,15,23H,4,14H2,1-3H3

InChIKey

MWVOGGOTSMCWDD-UHFFFAOYSA-N

Smiles

CCOC(=O)C1=C(C(=O)N(C1)C(C)C)Nc2ccc(cc2)Sc3ccccc3

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 1gm/kg (1000mg/kg)   Journal of Medicinal Chemistry. Vol. 24, Pg. 889, 1981.