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Substance Name: Disodium 4,4'-bis(4-anilino-6-((2-methoxyethyl)amino)-S-triazin-2-ylamino)stilbene-2,2'-disulfonate
RN: 3271-19-0
UNII: BPB45S270L
InChIKey: DZZFQJSTMHDDQG-QDBORUFSSA-L

Molecular Formula

  • C38-H40-N12-O8-S2.2Na

Molecular Weight

  • 900.9062
 
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Names and Synonyms

Name of Substance

  • Disodium 4,4'-bis(4-anilino-6-((2-methoxyethyl)amino)-S-triazin-2-ylamino)stilbene-2,2'-disulfonate

Synonym

  • UNII-BPB45S270L

Systematic Name

  • Benzenesulfonic acid, 2,2'-(1,2-ethenediyl)bis(5-((4-((2-methoxyethyl)amino)-6-(phenylamino)-1,3,5-triazine-2-yl)amino)-, disodium salt

Registry Numbers

CAS Registry Number

  • 3271-19-0

FDA UNII

  • BPB45S270L

System Generated Number

  • 0003271190

Molecular Formulas

Molecular Formula

  • C38-H40-N12-O8-S2.2Na

Molecular Formula Fragments

  • C38-H40-N12-O8-S2
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C38H40N12O8S2.2Na/c1-57-21-19-39-33-45-35(41-27-9-5-3-6-10-27)49-37(47-33)43-29-17-15-25(31(23-29)59(51,52)53)13-14-26-16-18-30(24-32(26)60(54,55)56)44-38-48-34(40-20-22-58-2)46-36(50-38)42-28-11-7-4-8-12-28;;/h3-18,23-24H,19-22H2,1-2H3,(H,51,52,53)(H,54,55,56)(H3,39,41,43,45,47,49)(H3,40,42,44,46,48,50);;/q;2*+1/p-2/b14-13+;;

InChIKey

DZZFQJSTMHDDQG-QDBORUFSSA-L

Smiles

COCCNc1nc(nc(n1)Nc2ccc(c(c2)S(=O)(=O)[O-])/C=C/c3ccc(cc3S(=O)(=O)[O-])Nc4nc(nc(n4)Nc5ccccc5)NCCOC)Nc6ccccc6.[Na+].[Na+]