SpectraBase Spectrum ID |
CYjyMDai1IN |
Name |
N-(2-(Cyanomethyl)-4'-methyl-[4,5'-bithiazol]-2'-yl)-4-methylbenzenesulfonamide |
Appearance |
Pale black crystals |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
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 |