| SpectraBase Spectrum ID |
9bHvNr2stDH |
| Name |
4-((2H-Pyrrol-2-yl)methyleneamino)-5-(4-isopropylthiazol-2-yl)-4H-1,2,4-triazole-3-thiol |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H14N6S2 |
| InChI |
InChI=1S/C13H14N6S2/c1-8(2)10-7-21-12(16-10)11-17-18-13(20)19(11)15-6-9-4-3-5-14-9/h3-9H,1-2H3,(H,18,20)/b15-6+ |
| InChIKey |
QOWANPMZYGNPON-GIDUJCDVSA-N |
| Molecular Weight |
318.417 g/mol |
| SMILES |
Sc1[n](c(-c2nc(C(C)C)cs2)nn1)\N=C\C1N=CC=C1 |
| SPLASH |
splash10-014i-0009000000-81e233d699067daf1600 |
| Source of Spectrum |
F2-45-2072-6k |
| Wiley ID |
1688925 |
