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Substance Name: EINECS 258-293-8
RN: 53014-11-2
InChIKey: QURZVYYMLRHGOA-UHFFFAOYSA-N

Molecular Formula

  • C33-H35-Cl2-N4-O4-S.Br

Molecular Weight

  • 734.5395
 
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Names and Synonyms

Results Name

  • EINECS 258-293-8

Synonym

  • EINECS 258-293-8

Systematic Name

  • 2-(3-(1-(4-((Acetamido)sulphonyl)butyl)-5,6-dichloro-3-ethyl-1,3-dihydro-2H-benzimidazol-2-ylidene)prop-1-enyl)-3-ethyl-5-phenylbenzoxazolium bromide

Registry Numbers

CAS Registry Number

  • 53014-11-2

System Generated Number

  • 0053014112

Molecular Formulas

Molecular Formula

  • C33-H35-Cl2-N4-O4-S.Br

Molecular Formula Fragments

  • Br
  • C33-H35-Cl2-N4-O4-S
  • COMPONENT

Structure Descriptors

InChI

1S/C33H34Cl2N4O4S.BrH/c1-4-37-28-21-26(34)27(35)22-29(28)39(18-9-10-19-44(41,42)36-23(3)40)32(37)14-11-15-33-38(5-2)30-20-25(16-17-31(30)43-33)24-12-7-6-8-13-24;/h6-8,11-17,20-22H,4-5,9-10,18-19H2,1-3H3;1H

InChIKey

QURZVYYMLRHGOA-UHFFFAOYSA-N

Smiles

CC[n+]1c2cc(ccc2oc1/C=C\C=C/3\N(c4cc(c(cc4N3CCCCS(=O)(=O)NC(=O)C)Cl)Cl)CC)c5ccccc5.[Br-]