| SpectraBase Spectrum ID |
B434NjJIhAe |
| Name |
([5-(2-Isobutoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl)acetic acid |
| CAS Registry Number |
50616-46-1 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H17N3O3S |
| InChI |
InChI=1S/C14H17N3O3S/c1-9(2)7-20-11-6-4-3-5-10(11)13-15-14(17-16-13)21-8-12(18)19/h3-6,9H,7-8H2,1-2H3,(H,18,19)(H,15,16,17) |
| InChIKey |
JXLVYQMAAMPLKK-UHFFFAOYSA-N |
| Molecular Weight |
307.368 g/mol |
| SMILES |
[nH]1c(nnc1SCC(=O)O)-c1c(cccc1)OCC(C)C |
| SPLASH |
splash10-052f-9540000000-d45910c5736b007f431b |
| Synonyms |
2-[5-(2-Isobutoxyphenyl)-4H-1,2,4-triazol-3-ylthio]acetic acid
2-[[5-(2-isobutoxyphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetic acid
2-[[5-(2-isobutoxyphenyl)-1H-1,2,4-triazol-3-yl]thio]acetic acid
2-[[5-[2-(2-methylpropoxy)phenyl]-1H-1,2,4-triazol-3-yl]sulfanyl]acetic acid
2-[[5-[2-(2-methylpropoxy)phenyl]-1H-1,2,4-triazol-3-yl]sulfanyl]ethanoic acid
2-[[5-[2-(2-methylpropoxy)phenyl]-1H-1,2,4-triazol-3-yl]thio]acetic acid |
| Wiley ID |
1467724 |
![([5-(2-Isobutoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl)acetic acid](/api/spectrum/B434NjJIhAe/structure.png?h=300&w=458 "([5-(2-Isobutoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl)acetic acid")
