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Substance Name: Butanoic acid, 4-((2-((4-chlorobenzoyl)amino)-4-(methylthio)-1-oxobutyl)(4-methoxyphenyl)amino)-, (S)-
RN: 71489-32-2
InChIKey: GSLBPPQCMKIKDT-FQEVSTJZSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C23-H27-Cl-N2-O5-S

Molecular Weight

  • 478.9943
 
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Names and Synonyms

Synonym

  • N-(N-(p-Chlorobenzoyl)methionyl)-4-(p-anisidino)butyric acid

Systematic Name

  • Butanoic acid, 4-((2-((4-chlorobenzoyl)amino)-4-(methylthio)-1-oxobutyl)(4-methoxyphenyl)amino)-, (S)-

Registry Numbers

CAS Registry Number

  • 71489-32-2

System Generated Number

  • 0071489322

Structure Descriptors

InChI

1S/C23H27ClN2O5S/c1-31-19-11-9-18(10-12-19)26(14-3-4-21(27)28)23(30)20(13-15-32-2)25-22(29)16-5-7-17(24)8-6-16/h5-12,20H,3-4,13-15H2,1-2H3,(H,25,29)(H,27,28)/t20-/m0/s1

InChIKey

GSLBPPQCMKIKDT-FQEVSTJZSA-N

Smiles

COc1ccc(cc1)N(CCCC(=O)O)C(=O)[C@H](CCSC)NC(=O)c2ccc(cc2)Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 700mg/kg (700mg/kg)   United States Patent Document. Vol. #4250183,