| SpectraBase Spectrum ID |
JKhqQVGjyZc |
| Name |
7-(4-Phenyl-5-thioxo-1,2,4-triazol-3-yl)methoxy-3,4- dimethyl-2H-1-benzopyran-2-one |
| Alternate Name(s) |
3,4-Dimethyl-7-((4-phenyl-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-3-yl)methoxy)-2H-chromen-2-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H17N3O3S |
| InChI |
InChI=1S/C20H17N3O3S/c1-12-13(2)19(24)26-17-10-15(8-9-16(12)17)25-11-18-21-22-20(27)23(18)14-6-4-3-5-7-14/h3-10H,11H2,1-2H3,(H,22,27) |
| InChIKey |
XZPGZRUVVRSWFA-UHFFFAOYSA-N |
| Molecular Weight |
379.434 g/mol |
| SMILES |
N1C(N(C(=N1)COc1cc2c(C(=C(C(O2)=O)C)C)cc1)c1ccccc1)=S |
| SPLASH |
splash10-01qc-5902000000-2946d6225124608b1b65 |
| Source of Spectrum |
Sohair L. El-Ansary, et al. Bioorganic Chemistry, V. 53, 2014, p. 50-66 |
| Wiley ID |
1817613 |
