Chem
J-GLOBAL ID:200907011161215785
Nikkaji number:J1.243.808G
N,N′-[1,4-Butanediylbis[imino(1,3-propanediyl)imino]bis(9,5-acridinediylmethylenethioethylene)]butanediamide
N,N′-[1,4-ブタンジイルビス[イミノ(1,3-プロパンジイル)イミノ]ビス(9,5-アクリジンジイルメチレンチオエチレン)]ブタンジアミド
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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:
C46 H56 N8 O2 S2
Molecular formula furigana:
C46-H56-N8-O2-S2
Molecular weight:
817.130
InChI:
InChI=1S/C46H56N8O2S2/c55-41-19-20-42(56)50-28-30-58-32-34-12-8-16-38-44(34)54-40-18-4-2-14-36(40)46(38)52-26-10-24-48-22-6-5-21-47-23-9-25-51-45-35-13-1-3-17-39(35)53-43-33(11-7-15-37(43)45)31-57-29-27-49-41/h1-4,7-8,11-18,47-48,51-52H,5-6,9-10,19-32H2,(H,49,55)(H,50,56)
InChI key:
UVLHFJPFDUIGIB-UHFFFAOYSA-N
SMILES:
O=C1CCC(=O)NCCSCc2cccc3c(NCCCNCCCCNCCCNc4c5ccccc5nc5c(CSCCN1)cccc45)c1ccccc1nc23
Systematic name (4):
N,N′-[1,4-ブタンジイルビス[イミノ(1,3-プロパンジイル)イミノ]ビス(9,5-アクリジンジイルメチレンチオエチレン)]ブタンジアミド
9,9′-(1,4-ブタンジイル)ビス[イミノ(3,1-プロパンジイル)(イミノ)][4,4′-(1,4-ジオキソ-1,4-ブタンジイル)ビス(イミノエチレンチオメチレン)ビスアクリジン]
7,18-ジチア-10,15,26,34,38,43,47,55-オクタアザヘプタシクロ[46.8.0.05,56 .020,25 .024,33 .027,32 .049,54 ]ヘキサペンタコンタ-1(48),2,4,20,22,24(33),25,27,29,31,49,51,53,55-テトラデカエン-11,14-ジオン
7,18-dithia-10,15,26,34,38,43,47,55-octaazaheptacyclo[46.8.0.05,56 .020,25 .024,33 .027,32 .049,54 ]hexapentaconta-1(48),2,4,20,22,24(33),25,27,29,31,49,51,53,55-tetradecaene-11,14-dione
Other name (2):
N,N′-[1,4-Butanediylbis[imino(1,3-propanediyl)imino]bis(9,5-acridinediylmethylenethioethylene)]butanediamide
9,9′-(1,4-Butanediyl)bis[imino(3,1-propanediyl)(imino)][4,4′-(1,4-dioxo-1,4-butanediyl)bis(iminoethylenethiomethylene)bisacridine]
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