Chem
J-GLOBAL ID：201507074304314193   Nikkaji number：J3.368.962D

3-[2-[[3-[3-(Oxylatosulfonyl)propyl]-3a,8b-dihydro[1]benzothieno[2,3-d]thiazole-3-ium]-2-ylmethylene]-2,3-dihydrobenzothiazole-3-yl]propane-1-sulfonic acid sodium salt

3-[2-[[3-[3-(オキシラトスルホニル)プロピル]-3a,8b-ジヒドロ[1]ベンゾチエノ[2,3-d]チアゾール-3-イウム]-2-イルメチレン]-2,3-ジヒドロベンゾチアゾール-3-イル]プロパン-1-スルホン酸ナトリウム
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： C23H23N[N+]NaO5[O-]S5
Molecular formula furigana： C23-H23-N2-NA-O6-S5
Molecular weight： 606.730
InChI： InChI=1S/C23H24N2O6S5.Na/c26-35(27,28)13-5-11-24-17-8-2-4-10-19(17)32-20(24)15-21-25(12-6-14-36(29,30)31)23-22(34-21)16-7-1-3-9-18(16)33-23;/h1-4,7-10,15,22-23H,5-6,11-14H2,(H-,26,27,28,29,30,31);/q;+1/p-1
InChI key： JCIJAURUSRBZIL-UHFFFAOYSA-M
SMILES： [O-]S(=O)(=O)CCC[N+]1=C(SC2C1Sc1ccccc21)C=c1sc2ccccc2n1CCCS(=O)(=O)O[Na]
Systematic name  (3)：
  • 3-[2-[[3-[3-(オキシラトスルホニル)プロピル]-3a,8b-ジヒドロ[1]ベンゾチエノ[2,3-d]チアゾール-3-イウム]-2-イルメチレン]-2,3-ジヒドロベンゾチアゾール-3-イル]プロパン-1-スルホン酸ナトリウム
  • 4-[(3-{3-[(ソジオオキシ)スルホニル]プロピル}-2,3-ジヒドロ-1,3-ベンゾチアゾール-2-イリデン)メチル]-5-(3-スルホナトプロピル)-3,7-ジチア-5-アザトリシクロ[6.4.0.02,6]ドデカ-1(12),4,8,10-テトラエン-5-イウム
  • 4-[(3-{3-[(sodiooxy)sulfonyl]propyl}-2,3-dihydro-1,3-benzothiazol-2-ylidene)methyl]-5-(3-sulfonatopropyl)-3,7-dithia-5-azatricyclo[6.4.0.02,6]dodeca-1(12),4,8,10-tetraen-5-ium
Other name (1)：
  • 3-[2-[[3-[3-(Oxylatosulfonyl)propyl]-3a,8b-dihydro[1]benzothieno[2,3-d]thiazole-3-ium]-2-ylmethylene]-2,3-dihydrobenzothiazole-3-yl]propane-1-sulfonic acid sodium salt
Thsaurus map：
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