| SpectraBase Spectrum ID |
C8cKqOGqVuf |
| Name |
(5Z)-3-(1,5-Dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-5-(3-hydroxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
423.071133764 u |
| Formula |
C21H17N3O3S2 |
| InChI |
InChI=1S/C21H17N3O3S2/c1-13-18(20(27)24(22(13)2)15-8-4-3-5-9-15)23-19(26)17(29-21(23)28)12-14-7-6-10-16(25)11-14/h3-12,25H,1-2H3/b17-12- |
| InChIKey |
QBNMIZBNMXRXCU-ATVHPVEESA-N |
| Molecular Weight |
423.505 g/mol |
| SMILES |
OC1=CC(\C=C\2C(N(C=3C(N(C=4C=CC=CC4)N(C3C)C)=O)C(S2)=S)=O)=CC=C1 |
