SpectraBase Spectrum ID |
7QRxV6VRyZR |
Name |
7-(4-Ethyl-5-thioxo-1,2,4-triazol-3-yl)methoxy-3,4- dimethyl-2H-1-benzopyran-2-one |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C16H17N3O3S |
InChI |
InChI=1S/C16H17N3O3S/c1-4-19-14(17-18-16(19)23)8-21-11-5-6-12-9(2)10(3)15(20)22-13(12)7-11/h5-7H,4,8H2,1-3H3,(H,18,23) |
InChIKey |
OROUQQCDIMHDPO-UHFFFAOYSA-N |
Molecular Weight |
331.390 g/mol |
SMILES |
N1C(N(C(=N1)COc1cc2c(C(=C(C(O2)=O)C)C)cc1)CC)=S |
SPLASH |
splash10-01za-6296000000-a82b78a6d6ae8942a5b6 |
Source of Spectrum |
Sohair L. El-Ansary, et al. Bioorganic Chemistry, V. 53, 2014, p. 50-66 |
Synonyms |
7-((4-ethyl-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-3-yl)methoxy)-3,4-dimethyl-2H-chromen-2-one |
Wiley ID |
1817612 |