SpectraBase Spectrum ID |
KPFkeoLLdL6 |
Name |
2-Furancarboxylic acid, 5-[[[5-(4-pyridinyl)-4H-1,2,4-triazol-3-yl]thio]methyl]-, methyl ester |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C14H12N4O3S |
InChI |
InChI=1S/C14H12N4O3S/c1-20-13(19)11-3-2-10(21-11)8-22-14-16-12(17-18-14)9-4-6-15-7-5-9/h2-7H,8H2,1H3,(H,16,17,18) |
InChIKey |
IHNYJMUUFRBDMU-UHFFFAOYSA-N |
Molecular Weight |
316.335 g/mol |
SMILES |
[nH]1c(nnc1-c1ccncc1)SCc1oc(C(=O)OC)cc1 |
SPLASH |
splash10-000i-6901000000-c007fcc07ff829ee9f37 |
Source of Spectrum |
IY-2-4721-4 |
Synonyms |
Methyl 5-({[5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)furan-2-carboxylate
5-[[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)thio]methyl]-2-furancarboxylic acid methyl ester
Methyl 5-[[5-(4-pyridyl)-1H-1,2,4-triazol-3-yl]sulfanylmethyl]furan-2-carboxylate
Methyl 5-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]furan-2-carboxylate |
Wiley ID |
1655197 |