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(8-Cyano-7-methylsulfanyl-4-oxo-4H-1,6-dithia-5-aza-as-indacen-5-yl)-acetic acid ethyl ester
SpectraBase Compound ID AWJ4AviaXc5
InChI InChI=1S/C15H12N2O3S3/c1-3-20-10(18)7-17-13(19)8-4-5-22-12(8)11-9(6-16)15(21-2)23-14(11)17/h4-5H,3,7H2,1-2H3
InChIKey WFRHEMCKMZPVPV-UHFFFAOYSA-N
Mol Weight 364.45 g/mol
Molecular Formula C15H12N2O3S3
Exact Mass 364.001006 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B3CHF6d5glk
Name (8-Cyano-7-methylsulfanyl-4-oxo-4H-1,6-dithia-5-aza-as-indacen-5-yl)-acetic acid ethyl ester
Alternate Name(s) Ethyl (8-cyano-7-(methylsulfanyl)-4-oxodithieno[2,3-b:2,3-d]pyridin-5(4H)-yl)acetate 2-[8-cyano-7-(methylthio)-4-oxo-5-dithieno[2,3-a:4',3'-d]pyridinyl]acetic acid ethyl ester Ethyl 2-(8-cyano-7-methylsulfanyl-4-oxodithieno[2,3-a:4',3'-d]pyridin-5-yl)acetate Ethyl 2-(8-cyano-7-methylsulfanyl-4-oxo-dithieno[2,3-a:4',3'-d]pyridin-5-yl)acetate Ethyl 2-(8-cyano-7-methylsulfanyl-4-oxidanylidene-dithieno[2,3-a:4',3'-d]pyridin-5-yl)ethanoate
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Formula C15H12N2O3S3
InChI InChI=1S/C15H12N2O3S3/c1-3-20-10(18)7-17-13(19)8-4-5-22-12(8)11-9(6-16)15(21-2)23-14(11)17/h4-5H,3,7H2,1-2H3
InChIKey WFRHEMCKMZPVPV-UHFFFAOYSA-N
Molecular Weight 364.452 g/mol
SMILES c1-2c(N(CC(=O)OCC)C(c3c2scc3)=O)sc(c1C#N)SC
SPLASH splash10-03dl-5495000000-619fd7f716234bd915b1
Wiley ID 1446545