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Substance Name: 2-((p-(Phenylazo)benzyl)sulphonyl)ethyl S-(acetamidomethyl)-L-cysteinate, mono(trifluoroacetate)
RN: 84712-95-8
InChIKey: PRHUZYRBOSSZTP-QOKWVQGISA-N

Molecular Formula

  • C21-H26-N4-O5-S2.C2-H-F3-O2

Molecular Weight

  • 592.6133
 
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Names and Synonyms

Synonym

  • EINECS 283-785-4

Systematic Name

  • 2-((p-(Phenylazo)benzyl)sulphonyl)ethyl S-(acetamidomethyl)-L-cysteinate, mono(trifluoroacetate)

Registry Numbers

CAS Registry Number

  • 84712-95-8

System Generated Number

  • 0084712958

Molecular Formulas

Molecular Formula

  • C21-H26-N4-O5-S2.C2-H-F3-O2

Molecular Formula Fragments

  • C2-H-F3-O2
  • C21-H26-N4-O5-S2
  • COMPONENT

Structure Descriptors

InChI

1S/C21H26N4O5S2.C2HF3O2/c1-16(26)23-15-31-13-20(22)21(27)30-11-12-32(28,29)14-17-7-9-19(10-8-17)25-24-18-5-3-2-4-6-18;3-2(4,5)1(6)7/h2-10,20H,11-15,22H2,1H3,(H,23,26);(H,6,7)/b25-24+;/t20-;/m0./s1

InChIKey

PRHUZYRBOSSZTP-QOKWVQGISA-N

Smiles

CC(=O)NCSC[C@@H](C(=O)OCCS(=O)(=O)Cc1ccc(cc1)/N=N/c2ccccc2)N.C(=O)(C(F)(F)F)O