Chem
J-GLOBAL ID：200907066784707599   Nikkaji number：J2.636.041B

2,5-Dibromo-8,9-bis[(2S)-2,6-dimethylheptyl]-3,4-dithia-7,10-diazabenzo[e]-as-indacene

2,5-ジブロモ-8,9-ビス[(2S)-2,6-ジメチルヘプチル]-3,4-ジチア-7,10-ジアザベンゾ[e]-as-インダセン
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： C30H40Br2N2S2
Molecular formula furigana： C30-H40-BR2-N2-S2
Molecular weight： 652.590
InChI： InChI=1S/C30H40Br2N2S2/c1-17(2)9-7-11-19(5)13-23-24(14-20(6)12-8-10-18(3)4)34-28-22-16-26(32)36-30(22)29-21(27(28)33-23)15-25(31)35-29/h15-20H,7-14H2,1-6H3/t19-,20-/m0/s1
InChI key： ZEQLYFBCOQBJMX-PMACEKPBSA-N
SMILES： CC(C)CCC[C@H](C)Cc1nc2c3cc(Br)sc3c3sc(Br)cc3c2nc1C[C@@H](C)CCCC(C)C
Systematic name  (3)：
  • 2,5-ジブロモ-8,9-ビス[(2S)-2,6-ジメチルヘプチル]-3,4-ジチア-7,10-ジアザベンゾ[e]-as-インダセン
  • 4,9-ジブロモ-14,15-ビス[(2S)-2,6-ジメチルヘプチル]-5,8-ジチア-13,16-ジアザテトラシクロ[10.4.0.02,6.07,11]ヘキサデカ-1(16),2(6),3,7(11),9,12,14-ヘプタエン
  • 4,9-dibromo-14,15-bis[(2S)-2,6-dimethylheptyl]-5,8-dithia-13,16-diazatetracyclo[10.4.0.02,6.07,11]hexadeca-1(16),2(6),3,7(11),9,12,14-heptaene
Other name (1)：
  • 2,5-Dibromo-8,9-bis[(2S)-2,6-dimethylheptyl]-3,4-dithia-7,10-diazabenzo[e]-as-indacene
Thsaurus map：
Thesaurus Map

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