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N-(2-(Cyanomethyl)-4'-methyl-[4,5'-bithiazol]-2'-yl)-4-methylbenzenesulfonamide
SpectraBase Compound ID 2XAMh3SSSFz
InChI InChI=1S/C16H14N4O2S3/c1-10-3-5-12(6-4-10)25(21,22)20-16-18-11(2)15(24-16)13-9-23-14(19-13)7-8-17/h3-6,9H,7H2,1-2H3,(H,18,20)
InChIKey CVKAXPAUVYQHIY-UHFFFAOYSA-N
Mol Weight 390.49 g/mol
Molecular Formula C16H14N4O2S3
Exact Mass 390.027889 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CYjyMDai1IN
Name N-(2-(Cyanomethyl)-4'-methyl-[4,5'-bithiazol]-2'-yl)-4-methylbenzenesulfonamide
Appearance Pale black crystals
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Formula C16H14N4O2S3
InChI InChI=1S/C16H14N4O2S3/c1-10-3-5-12(6-4-10)25(21,22)20-16-18-11(2)15(24-16)13-9-23-14(19-13)7-8-17/h3-6,9H,7H2,1-2H3,(H,18,20)
InChIKey CVKAXPAUVYQHIY-UHFFFAOYSA-N
Instrument Name VG Autospec
Ionization Type EI
Literature Reference DOI 10.1002/jhet.3995
Molecular Weight 390.494 g/mol
SMILES N(S(=O)(=O)c1ccc(cc1)C)c1sc(c(n1)C)-c1nc(sc1)CC#N
SPLASH splash10-00kv-4194000000-6d4e65ebc800102bdae7
Source of Spectrum Y-57-2867-2
Wiley ID 1860251