Chem
J-GLOBAL ID:200907024850870116   Nikkaji number:J2.093.922B

4-[(Z)-2-[1-[7-(Acetylthio)heptyl]quinolinium-4-yl]-1-cyanoethenyl]phenyldicyanomethaneide

4-[(Z)-2-[1-[7-(アセチルチオ)ヘプチル]キノリニウム-4-イル]-1-シアノエテニル]フェニルジシアノメタンイド
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: C29[C-]H28N3[N+]OS
Molecular formula furigana: C30-H28-N4-O-S
Molecular weight: 492.640
InChI: InChI=1S/C30H28N4OS/c1-23(35)36-18-8-4-2-3-7-16-34-17-15-26(29-9-5-6-10-30(29)34)19-27(20-31)24-11-13-25(14-12-24)28(21-32)22-33/h5-6,9-15,17,19H,2-4,7-8,16,18H2,1H3/b27-19+
InChI key: NKBMJNNXJYQRAO-ZXVVBBHZSA-N
SMILES: CC(=O)SCCCCCCC[n+]1ccc(/C=C(\C#N)/c2ccc(cc2)[C-](C#N)C#N)c2ccccc12
Systematic name  (3):
  • 4-[(Z)-2-[1-[7-(アセチルチオ)ヘプチル]キノリニウム-4-イル]-1-シアノエテニル]フェニルジシアノメタンイド
  • {4-[(1Z)-2-{1-[7-(アセチルスルファニル)ヘプチル]キノリン-1-イウム-4-イル}-1-シアノエタ-1-エン-1-イル]フェニル}ジシアノメタニド
  • {4-[(1Z)-2-{1-[7-(acetylsulfanyl)heptyl]quinolin-1-ium-4-yl}-1-cyanoeth-1-en-1-yl]phenyl}dicyanomethanide
Other name (1):
  • 4-[(Z)-2-[1-[7-(Acetylthio)heptyl]quinolinium-4-yl]-1-cyanoethenyl]phenyldicyanomethaneide
Thsaurus map:

Return to Previous Page