Chem
J-GLOBAL ID：200907078242406159   Nikkaji number：J1.013.963E

6,6′-[Ethylenebis(nitrilomethylidyne)][2,2′-[thiobis(ethylenenitrilomethylidyne)]bis(4-methylphenol anion)]

6,6′-[エチレンビス(ニトリロメチリジン)][2,2′-[チオビス(エチレンニトリロメチリジン)]ビス(4-メチルフェノールアニオン)]
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： C24H26N4[O-]2S
Molecular formula furigana： C24-H26-N4-O2-S
Molecular weight： 434.560
InChI： InChI=1S/C24H28N4O2S/c1-17-9-19-13-25-3-4-26-14-20-10-18(2)12-22(24(20)30)16-28-6-8-31-7-5-27-15-21(11-17)23(19)29/h9-16,29-30H,3-8H2,1-2H3/p-2
InChI key： AEXSXLXVARCEFT-UHFFFAOYSA-L
SMILES： Cc1cc2C=NCCSCCN=Cc3cc(C)cc(C=NCCN=Cc(c1)c2[O-])c3[O-]
Systematic name  (3)：
  • 6,6′-[エチレンビス(ニトリロメチリジン)][2,2′-[チオビス(エチレンニトリロメチリジン)]ビス(4-メチルフェノールアニオン)]
  • 10,24-ジメチル-17-チア-3,6,14,20-テトラアザトリシクロ[20.3.1.18,12]ヘプタコサ-1(26),2,6,8,10,12(27),13,20,22,24-デカエン-26,27-ビス(オラート)
  • 10,24-dimethyl-17-thia-3,6,14,20-tetraazatricyclo[20.3.1.18,12]heptacosa-1(26),2,6,8,10,12(27),13,20,22,24-decaene-26,27-bis(olate)
Other name (1)：
  • 6,6′-[Ethylenebis(nitrilomethylidyne)][2,2′-[thiobis(ethylenenitrilomethylidyne)]bis(4-methylphenol anion)]
Thsaurus map：
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