Chem
J-GLOBAL ID：201107083237295367
Nikkaji number：J2.978.882K
2-(5′-Hexyl-2,2′-bithiophene-5-yl)ethene-1,1,2-tricarbonitrile
2-(5′-ヘキシル-2,2′-ビチオフェン-5-イル)エテン-1,1,2-トリカルボニトリル
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
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
Molecular formula： C19H17N3S2
Molecular formula furigana： C19-H17-N3-S2
Molecular weight： 351.490
InChI：
InChI=1S/C19H17N3S2/c1-2-3-4-5-6-15-7-8-18(23-15)19-10-9-17(24-19)16(13-22)14(11-20)12-21/h7-10H,2-6H2,1H3
InChI key：
HEKLZCAHYBCRQH-UHFFFAOYSA-N
SMILES：
CCCCCCc1ccc(s1)c1ccc(s1)C(=C(C#N)C#N)C#N
Systematic name (3)：
- 2-(5′-ヘキシル-2,2′-ビチオフェン-5-イル)エテン-1,1,2-トリカルボニトリル
- 1-{5'-ヘキシル-[2,2'-ビチオフェン]-5-イル}エタ-1-エン-1,2,2-トリカルボニトリル
- 1-{5'-hexyl-[2,2'-bithiophen]-5-yl}eth-1-ene-1,2,2-tricarbonitrile
- 2-(5′-Hexyl-2,2′-bithiophene-5-yl)ethene-1,1,2-tricarbonitrile
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