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Substance Name: Thiocyanic acid, 2-(2-(4-(bis(2-(acetyloxy)ethyl)amino)-2-methylphenyl)diazenyl)-6-benzothiazolyl ester
RN: 71002-18-1
InChIKey: PUGQCSKAHXIMHN-CYYJNZCTSA-N

Molecular Formula

  • C23-H23-N5-O4-S2

Molecular Weight

  • 497.598
 
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Names and Synonyms

Synonyms

  • EINECS 275-106-5
  • Thiocyanic acid, 2-((4-((bis(2-(acetyloxy)ethyl))amino)-2-methylphenyl)azo)-6-benzothiazolyl ester

Systematic Names

  • 2-((4-(Bis(2-(acetyloxy)ethyl)amino)-2-methylphenyl)azo)benzothiazol-6-yl thiocyanate
  • Thiocyanic acid, 2-((4-(bis(2-(acetyloxy)ethyl)amino)-2-methylphenyl)azo)-6-benzothiazolyl ester
  • Thiocyanic acid, 2-(2-(4-(bis(2-(acetyloxy)ethyl)amino)-2-methylphenyl)diazenyl)-6-benzothiazolyl ester

Registry Numbers

CAS Registry Number

  • 71002-18-1

System Generated Number

  • 0071002181

Structure Descriptors

InChI

1S/C23H23N5O4S2/c1-15-12-18(28(8-10-31-16(2)29)9-11-32-17(3)30)4-6-20(15)26-27-23-25-21-7-5-19(33-14-24)13-22(21)34-23/h4-7,12-13H,8-11H2,1-3H3/b27-26+

InChIKey

PUGQCSKAHXIMHN-CYYJNZCTSA-N

Smiles

O=C(OCCN(c1ccc(\N=N\c2nc3c(cc(SC#N)cc3)s2)c(C)c1)CCOC(=O)C)C