Chem
J-GLOBAL ID：200907030632469523   Nikkaji number：J1.477.471H

Thiophosphoric acid tris[4-[[2-methyl-2-[bis[4-(2-methyl-1,3-cyclopentadienylmethyl)phenoxy]thiophophinyl]hydrazono]methyl]phenyl] ester

チオりん酸トリス[4-[[2-メチル-2-[ビス[4-(2-メチル-1,3-シクロペンタジエニルメチル)フェノキシ]チオホスフィニル]ヒドラゾノ]メチル]フェニル]
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： C102H102N6O9P4S4
Molecular formula furigana： C102-H102-N6-O9-P4-S4
Molecular weight： 1808.110
InChI： InChI=1S/C102H102N6O9P4S4/c1-73-16-10-22-88(73)64-79-28-46-94(47-29-79)109-118(122,110-95-48-30-80(31-49-95)65-89-23-11-17-74(89)2)106(7)103-70-85-40-58-100(59-41-85)115-121(125,116-101-60-42-86(43-61-101)71-104-107(8)119(123,111-96-50-32-81(33-51-96)66-90-24-12-18-75(90)3)112-97-52-34-82(35-53-97)67-91-25-13-19-76(91)4)117-102-62-44-87(45-63-102)72-105-108(9)120(124,113-98-54-36-83(37-55-98)68-92-26-14-20-77(92)5)114-99-56-38-84(39-57-99)69-93-27-15-21-78(93)6/h10-21,28-63,70-72H,22-27,64-69H2,1-9H3
InChI key： GMSBGADGIRFAHO-UHFFFAOYSA-N
SMILES： CN(N=Cc1ccc(OP(=S)(Oc2ccc(C=NN(C)P(=S)(Oc3ccc(CC4=C(C)C=CC4)cc3)Oc3ccc(CC4=C(C)C=CC4)cc3)cc2)Oc2ccc(C=NN(C)P(=S)(Oc3ccc(CC4=C(C)C=CC4)cc3)Oc3ccc(CC4=C(C)C=CC4)cc3)cc2)cc1)P(=S)(Oc1ccc(CC2=C(C)C=CC2)cc1)Oc1ccc(CC2=C(C)C=CC2)cc1
Systematic name  (3)：
  • チオりん酸トリス[4-[[2-メチル-2-[ビス[4-(2-メチル-1,3-シクロペンタジエニルメチル)フェノキシ]チオホスフィニル]ヒドラゾノ]メチル]フェニル]
  • O,O,O-トリス[4-({2-[ビス({4-[(2-メチルシクロペンタ-1,3-ジエン-1-イル)メチル]フェノキシ})(スルファニリデン)-λ5-ホスファニル]-2-メチルヒドラジン-1-イリデン}メチル)フェニル] ホスホロチオアート
  • O,O,O-tris[4-({2-[bis({4-[(2-methylcyclopenta-1,3-dien-1-yl)methyl]phenoxy})(sulfanylidene)-λ5-phosphanyl]-2-methylhydrazin-1-ylidene}methyl)phenyl] phosphorothioate
Other name (1)：
  • Thiophosphoric acid tris[4-[[2-methyl-2-[bis[4-(2-methyl-1,3-cyclopentadienylmethyl)phenoxy]thiophophinyl]hydrazono]methyl]phenyl] ester
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