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Substance Name: S-(4-Bromophenyl)mercapturic acid
RN: 3343-66-6
UNII: 48NZ5HZ4J6
InChIKey: FZPBUFAQZNZYPA-JTQLQIEISA-N

Molecular Formula

  • C11-H12-Br-N-O3-S

Molecular Weight

  • 318.19
 
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Names and Synonyms

Name of Substance

  • S-(4-Bromophenyl)mercapturic acid

Synonyms

  • N-Acetyl-S-(4-bromophenyl)cysteine
  • P-Bpma
  • para-Bromophenylmercapturic acid
  • UNII-48NZ5HZ4J6

Systematic Name

  • Cysteine, N-acetyl-S-(4-bromophenyl)-

Registry Numbers

CAS Registry Number

  • 3343-66-6

FDA UNII

  • 48NZ5HZ4J6

System Generated Number

  • 0003343666

Structure Descriptors

InChI

1S/C11H12BrNO3S/c1-7(14)13-10(11(15)16)6-17-9-4-2-8(12)3-5-9/h2-5,10H,6H2,1H3,(H,13,14)(H,15,16)/t10-/m0/s1

InChIKey

FZPBUFAQZNZYPA-JTQLQIEISA-N

Smiles

C([C@H](CSc1ccc(cc1)Br)NC(C)=O)(=O)O