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3-(4',4'-Dicyanomethylene-cyclohexa[a]-2,5-dienyl)-4-oxo-6,7,8,9-tetradihydro-5H-cyclohepta[4,5][1,3]thiazolo[3,2-a]thieno[2,3-d]pyrimidin-2-ylidene-2-dicarbonitrile
SpectraBase Compound ID FMDdrd5TQic
InChI InChI=1S/C23H14N6OS2/c24-10-15(11-25)14-6-8-23(9-7-14)22(12-26,13-27)29-20(30)18-16-4-2-1-3-5-17(16)31-19(18)28-21(29)32-23/h6-9H,1-5H2
InChIKey CEBXYHJVSJOXAP-UHFFFAOYSA-N
Mol Weight 454.53 g/mol
Molecular Formula C23H14N6OS2
Exact Mass 454.067051 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 91PSwSoBNri
Name 3-(4',4'-Dicyanomethylene-cyclohexa[a]-2,5-dienyl)-4-oxo-6,7,8,9-tetradihydro-5H-cyclohepta[4,5][1,3]thiazolo[3,2-a]thieno[2,3-d]pyrimidin-2-ylidene-2-dicarbonitrile
Alternate Name(s) 5-Oxo-7,8,9,10-tetrahydro-6H-spiro[4',4'-Dicyanomethylene-cyclohexa-2',5'-dienyl-1',2-cyclohepta[4,5][1,3]thiazolo[3,2-a]thieno[2,3-d]pyrimidine]-3-dicarbonitrile 4'-(dicyanomethylene)-5-oxo-7,8,9,10-tetrahydro-3H-spiro[cyclohepta[4,5]thieno[2,3-d]thiazolo[3,2-a]pyrimidine-2,1'-cyclohexa[2,5]diene]-3,3(5H,6H)-dicarbonitrile
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Formula C23H14N6OS2
InChI InChI=1S/C23H14N6OS2/c24-10-15(11-25)14-6-8-23(9-7-14)22(12-26,13-27)29-20(30)18-16-4-2-1-3-5-17(16)31-19(18)28-21(29)32-23/h6-9H,1-5H2
InChIKey CEBXYHJVSJOXAP-UHFFFAOYSA-N
Molecular Weight 454.526 g/mol
SMILES C1=2N(C(c3c4c(sc3N2)CCCCC4)=O)C(C2(S1)C=CC(=C(C#N)C#N)C=C2)(C#N)C#N
SPLASH splash10-0udi-1422900000-b8ef744aa25d9ae67d7f
Source of Spectrum Y-49-1016-6c
Wiley ID 1736304