SpectraBase Spectrum ID |
LPEK7yHqOPl |
Name |
3-[[5-(4-methoxyphenyl)-4-(1,2,4-triazol-1-yl)-1H-pyrazol-3-yl]sulfanyl]propane-1-thiol |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C15H17N5OS2 |
InChI |
InChI=1S/C15H17N5OS2/c1-21-12-5-3-11(4-6-12)13-14(20-10-16-9-17-20)15(19-18-13)23-8-2-7-22/h3-6,9-10,22H,2,7-8H2,1H3,(H,18,19) |
InChIKey |
KYFHBAJHQACIPJ-UHFFFAOYSA-N |
Molecular Weight |
347.455 g/mol |
SMILES |
[nH]1nc(c(c1SCCCS)-[n]1ncnc1)-c1ccc(cc1)OC |
SPLASH |
splash10-0035-9302000000-d0dad0877205d19bda29 |
Source of Spectrum |
SK-26-3118-3 |
Synonyms |
3-[[5-(4-methoxyphenyl)-4-(1,2,4-triazol-1-yl)-1H-pyrazol-3-yl]thio]-1-propanethiol
3-[[5-(4-methoxyphenyl)-4-(1,2,4-triazol-1-yl)-1H-pyrazol-3-yl]thio]propane-1-thiol |
Wiley ID |
867393 |