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7-(1-azepanyl)-3-methyl-2-thiazolo[4,5-d]pyrimidinethione
SpectraBase Compound ID A5sIFAvfuUh
InChI InChI=1S/C12H16N4S2/c1-15-10-9(18-12(15)17)11(14-8-13-10)16-6-4-2-3-5-7-16/h8H,2-7H2,1H3
InChIKey JECBBXLTPHNIEZ-UHFFFAOYSA-N
Mol Weight 280.41 g/mol
Molecular Formula C12H16N4S2
Exact Mass 280.081639 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JVfloephMTi
Name 7-(1-azepanyl)-3-methyl-2-thiazolo[4,5-d]pyrimidinethione
Alternate Name(s) 7-(azepan-1-yl)-3-methyl-thiazolo[4,5-d]pyrimidine-2-thione 7-(azepan-1-yl)-3-methyl-[1,3]thiazolo[4,5-d]pyrimidine-2-thione
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Formula C12H16N4S2
InChI InChI=1S/C12H16N4S2/c1-15-10-9(18-12(15)17)11(14-8-13-10)16-6-4-2-3-5-7-16/h8H,2-7H2,1H3
InChIKey JECBBXLTPHNIEZ-UHFFFAOYSA-N
Molecular Weight 280.408 g/mol
SMILES c12c(N(C)C(S2)=S)ncnc1N1CCCCCC1
SPLASH splash10-0083-9470000000-034c57fdf6777e9f93bf
Wiley ID 1451116