Chem
J-GLOBAL ID:201307013692867561
Nikkaji number:J3.126.794C
4,5-Bis(methylthio)-5′-thioxo-Δ2,2′:4′(5′H),2′′ -ter[1,3-dithiol]-4′′,5′′-dicarboxylic acid dimethyl ester
4,5-ビス(メチルチオ)-5′-チオキソ-Δ2,2′:4′(5′H),2′′ -テル[1,3-ジチオール]-4′′,5′′-ジカルボン酸ジメチル
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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:
C15 H12 O4 S9
Molecular formula furigana:
C15-H12-O4-S9
Molecular weight:
544.800
InChI:
InChI=1S/C15H12O4S9/c1-18-8(16)5-6(9(17)19-2)24-11(23-5)7-10(20)26-14(25-7)15-27-12(21-3)13(22-4)28-15/h1-4H3
InChI key:
XJDLBZPGYAGCSC-UHFFFAOYSA-N
SMILES:
COC(=O)C1=C(S/C(=c/2\s/c(=C/3\SC(=C(SC)S3)SC)/sc2=S)/S1)C(=O)OC
Systematic name (6):
4′,5′-ビス(メチルチオ)-4,5-ジヒドロ-4-チオキソ-5-[4,5-ビス(メトキシカルボニル)-1,3-ジチオール-2-イリデン]-Δ2,2′ -ビ[1,3-ジチオール]
4,5-ビス(メチルチオ)-5′-チオキソ-Δ2,2′:4′(5′H),2′′ -テル[1,3-ジチオール]-4′′,5′′-ジカルボン酸ジメチル
2-[2-[4,5-ビス(メチルチオ)-1,3-ジチオール-2-イリデン]-5-チオキソ-1,3-ジチオラン-4-イリデン]-1,3-ジチオール-4,5-ジカルボン酸ジメチル
2-[2-[4,5-ジ(メチルチオ)-1,3-ジチオール-2-イリデン]-4-チオキソ-1,3-ジチオラン-5-イリデン]-1,3-ジチオール-4,5-ジカルボン酸ジメチル
4,5-ジメチル 2-{2-[4,5-ビス(メチルスルファニル)-2H-1,3-ジチオール-2-イリデン]-5-スルファニリデン-1,3-ジチオラン-4-イリデン}-2H-1,3-ジチオール-4,5-ジカルボキシラート
4,5-dimethyl 2-{2-[4,5-bis(methylsulfanyl)-2H-1,3-dithiol-2-ylidene]-5-sulfanylidene-1,3-dithiolan-4-ylidene}-2H-1,3-dithiole-4,5-dicarboxylate
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Other name (4):
4′,5′-Bis(methylthio)-4,5-dihydro-4-thioxo-5-[4,5-bis(methoxycarbonyl)-1,3-dithiol-2-ylidene]-Δ2,2′ -bi[1,3-dithiol]
4,5-Bis(methylthio)-5′-thioxo-Δ2,2′:4′(5′H),2′′ -ter[1,3-dithiol]-4′′,5′′-dicarboxylic acid dimethyl ester
2-[2-[4,5-Bis(methylthio)-1,3-dithiol-2-ylidene]-5-thioxo-1,3-dithiolane-4-ylidene]-1,3-dithiol-4,5-dicarboxylic acid dimethyl ester
2-[2-[4,5-Di(methylthio)-1,3-dithiol-2-ylidene]-4-thioxo-1,3-dithiolane-5-ylidene]-1,3-dithiol-4,5-dicarboxylic acid dimethyl ester
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