Chem
J-GLOBAL ID:200907082345019002   Nikkaji number:J309.898B

2,2′-(1,2-Ethenediyl)bis[5-[[4-(4-morpholinyl)-6-[[3-(sodiosulfo)phenyl]amino]-1,3,5-triazin-2-yl]amino]benzenesulfonic acid]disodium salt

2,2′-(1,2-エテンジイル)ビス[5-[[4-(4-モルホリニル)-6-[[3-(ソジオスルホ)フェニル]アミノ]-1,3,5-トリアジン-2-イル]アミノ]ベンゼンスルホン酸]ジナトリウム
Substance type:
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula: C40H36N12Na4O14S4
Molecular formula furigana: C40-H36-N12-NA4-O14-S4
Molecular weight: 1129.000
InChI: InChI=1S/C40H40N12O14S4.4Na/c53-67(54,55)31-5-1-3-27(21-31)41-35-45-37(49-39(47-35)51-13-17-65-18-14-51)43-29-11-9-25(33(23-29)69(59,60)61)7-8-26-10-12-30(24-34(26)70(62,63)64)44-38-46-36(48-40(50-38)52-15-19-66-20-16-52)42-28-4-2-6-32(22-28)68(56,57)58;;;;/h1-12,21-24H,13-20H2,(H,53,54,55)(H,56,57,58)(H,59,60,61)(H,62,63,64)(H2,41,43,45,47,49)(H2,42,44,46,48,50);;;;/q;4*+1/p-4
InChI key: APBQAOVDWIUKOY-UHFFFAOYSA-J
SMILES: [Na]OS(=O)(=O)c1cccc(Nc2nc(Nc3ccc(C=Cc4ccc(Nc5nc(Nc6cccc(c6)S(=O)(=O)O[Na])nc(n5)N5CCOCC5)cc4S(=O)(=O)O[Na])c(c3)S(=O)(=O)O[Na])nc(n2)N2CCOCC2)c1
Systematic name  (3):
  • 2,2′-(1,2-エテンジイル)ビス[5-[[4-(4-モルホリニル)-6-[[3-(ソジオスルホ)フェニル]アミノ]-1,3,5-トリアジン-2-イル]アミノ]ベンゼンスルホン酸]ジナトリウム
  • ナトリウム 5-{[4-(モルホリン-4-イル)-6-({3-[(ソジオオキシ)スルホニル]フェニル}アミノ)-1,3,5-トリアジン-2-イル]アミノ}-2-[2-(4-{[4-(モルホリン-4-イル)-6-({3-[(ソジオオキシ)スルホニル]フェニル}アミノ)-1,3,5-トリアジン-2-イル]アミノ}-2-[(ソジオオキシ)スルホニル]フェニル)エテニル]ベンゼン-1-スルホナート
  • sodium 5-{[4-(morpholin-4-yl)-6-({3-[(sodiooxy)sulfonyl]phenyl}amino)-1,3,5-triazin-2-yl]amino}-2-[2-(4-{[4-(morpholin-4-yl)-6-({3-[(sodiooxy)sulfonyl]phenyl}amino)-1,3,5-triazin-2-yl]amino}-2-[(sodiooxy)sulfonyl]phenyl)ethenyl]benzene-1-sulfonate
Other name (1):
  • 2,2′-(1,2-Ethenediyl)bis[5-[[4-(4-morpholinyl)-6-[[3-(sodiosulfo)phenyl]amino]-1,3,5-triazin-2-yl]amino]benzenesulfonic acid]disodium salt
CAS registry number: 42355-81-7
Regulation number (1):
  • EINECS2557697
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