| SpectraBase Spectrum ID |
3zBglmI7ou |
| Name |
4-[3-(5-cyclopropyl-1H-pyrazol-3-yl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]benzoic acid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H13N5O2S |
| InChI |
InChI=1S/C15H13N5O2S/c21-14(22)9-3-5-10(6-4-9)20-13(18-19-15(20)23)12-7-11(16-17-12)8-1-2-8/h3-8H,1-2H2,(H,16,17)(H,19,23)(H,21,22) |
| InChIKey |
CITMGAYWFLLRGW-UHFFFAOYSA-N |
| Molecular Weight |
327.362 g/mol |
| SMILES |
Sc1nnc([n]1-c1ccc(C(=O)O)cc1)-c1cc(C2CC2)n[nH]1 |
| SPLASH |
splash10-0gbj-9300000000-bd4aced0ae0bdad681e1 |
| Synonyms |
4-[3-(5-cyclopropyl-1H-pyrazol-3-yl)-5-thioxo-1H-1,2,4-triazol-4-yl]benzoic acid
Benzoic acid, 4-[3-(5-cyclopropyl-2H-pyrazol-3-yl)-5-mercapto-[1,2,4]triazol-4-yl]- |
| Wiley ID |
1441284 |
![4-[3-(5-cyclopropyl-1H-pyrazol-3-yl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]benzoic acid](/api/spectrum/3zBglmI7ou/structure.png?h=300&w=458 "4-[3-(5-cyclopropyl-1H-pyrazol-3-yl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]benzoic acid")
