SpectraBase Spectrum ID |
DPPzyo0P0ZP |
Name |
N-{3-({2-[(Acetyl)amino]-1,3-thiazol-4-yl}methyl)-5-[(cyanomethyl)sulfanyl]-4H-1,2,4-triazol-4-yl}benzamide |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C17H15N7O2S2 |
InChI |
InChI=1S/C17H15N7O2S2/c1-11(25)19-16-20-13(10-28-16)9-14-21-22-17(27-8-7-18)24(14)23-15(26)12-5-3-2-4-6-12/h2-6,10H,8-9H2,1H3,(H,23,26)(H,19,20,25) |
InChIKey |
WDIWPOWDVBIWKH-UHFFFAOYSA-N |
Molecular Weight |
413.474 g/mol |
SMILES |
N(c1nc(Cc2[n](c(nn2)SCC#N)NC(=O)c2ccccc2)cs1)C(=O)C |
SPLASH |
splash10-03k9-3063900000-ccbfa348ea0561b7930f |
Source of Spectrum |
EMC-42-811-4b |
Synonyms |
N-(3-((2-acetamidothiazol-4-yl)methyl)-5-((cyanomethyl)thio)-4H-1,2,4-triazol-4-yl)benzamide
N-[3-[(2-acetamido-4-thiazolyl)methyl]-5-(cyanomethylthio)-1,2,4-triazol-4-yl]benzamide
N-[3-[(2-acetamidothiazol-4-yl)methyl]-5-(cyanomethylsulfanyl)-1,2,4-triazol-4-yl]benzamide
N-[3-[(2-acetamido-1,3-thiazol-4-yl)methyl]-5-(cyanomethylsulfanyl)-1,2,4-triazol-4-yl]benzamide |
Wiley ID |
1735083 |