Chem
J-GLOBAL ID：200907012782538916   Nikkaji number：J1.404.458B

1,1′-[(10-Methoxyanthracene-1,8-diyl)bisethynylene]-3,3′:5,5′-bis(thiobismethylene)bisbenzene

1,1′-[(10-メトキシアントラセン-1,8-ジイル)ビスエチニレン]-3,3′:5,5′-ビス(チオビスメチレン)ビスベンゼン
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： C35H24OS2
Molecular formula furigana： C35-H24-O-S2
Molecular weight： 524.700
InChI： InChI=1S/C35H24OS2/c1-36-35-31-6-2-4-29-10-8-23-12-25-16-26(13-23)20-38-22-28-15-24(14-27(17-28)21-37-19-25)9-11-30-5-3-7-32(35)34(30)18-33(29)31/h2-7,12-18H,19-22H2,1H3
InChI key： DICBQRNERBSVID-UHFFFAOYSA-N
SMILES： COc1c2cccc3C#Cc4cc5CSCc6cc(CSCc(c5)c4)cc(c6)C#Cc4cccc1c4cc23
Systematic name  (3)：
  • 1,1′-[(10-メトキシアントラセン-1,8-ジイル)ビスエチニレン]-3,3′:5,5′-ビス(チオビスメチレン)ビスベンゼン
  • 36-メトキシ-27,32-ジチアヘプタシクロ[21.7.3.13,29.110,14.121,25.06,11.013,18]ヘキサトリアコンタ-1,3(34),6,8,10(36),11,13(18),14,16,21(35),22,24,29-トリデカエン-4,19-ジイン
  • 36-methoxy-27,32-dithiaheptacyclo[21.7.3.13,29.110,14.121,25.06,11.013,18]hexatriaconta-1,3(34),6,8,10(36),11,13(18),14,16,21(35),22,24,29-tridecaen-4,19-diyne
Other name (1)：
  • 1,1′-[(10-Methoxyanthracene-1,8-diyl)bisethynylene]-3,3′:5,5′-bis(thiobismethylene)bisbenzene
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