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N-(2-(Dicyanomethylene)-4'-methyl-3-phenyl-2,3-dihydro-[4,5'-bithiazol]-2'-yl)-4-methylbenzenesulfonamide
SpectraBase Compound ID IzlgvEc9rfy
InChI InChI=1S/C23H17N5O2S3/c1-15-8-10-19(11-9-15)33(29,30)27-23-26-16(2)21(32-23)20-14-31-22(17(12-24)13-25)28(20)18-6-4-3-5-7-18/h3-11,14H,1-2H3,(H,26,27)
InChIKey VMYXCHQPIYKBAR-UHFFFAOYSA-N
Mol Weight 491.6 g/mol
Molecular Formula C23H17N5O2S3
Exact Mass 491.054438 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2rCnFubEU5s
Name N-(2-(Dicyanomethylene)-4'-methyl-3-phenyl-2,3-dihydro-[4,5'-bithiazol]-2'-yl)-4-methylbenzenesulfonamide
Appearance Yellow crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H17N5O2S3
InChI InChI=1S/C23H17N5O2S3/c1-15-8-10-19(11-9-15)33(29,30)27-23-26-16(2)21(32-23)20-14-31-22(17(12-24)13-25)28(20)18-6-4-3-5-7-18/h3-11,14H,1-2H3,(H,26,27)
InChIKey VMYXCHQPIYKBAR-UHFFFAOYSA-N
Instrument Name VG Autospec
Ionization Type EI
Literature Reference DOI 10.1002/jhet.3995
Molecular Weight 491.602 g/mol
SMILES N(S(c1ccc(cc1)C)(=O)=O)c1sc(c(n1)C)C=1N(C(SC1)=C(C#N)C#N)c1ccccc1
SPLASH splash10-0006-9322600000-2e63527be678760a9ecd
Source of Spectrum Y-57-2871-10
Wiley ID 1860243