| SpectraBase Spectrum ID |
3ox9nWvOq5r |
| Name |
(2E)-3-(4-Fluorophenyl)-N-({2-[(5-methyl-3-phenyl-4-isoxazolyl)carbonyl]hydrazino}carbothioyl)-2-propenamide |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
424.100539757 u |
| Formula |
C21H17FN4O3S |
| InChI |
InChI=1S/C21H17FN4O3S/c1-13-18(19(26-29-13)15-5-3-2-4-6-15)20(28)24-25-21(30)23-17(27)12-9-14-7-10-16(22)11-8-14/h2-12H,1H3,(H,24,28)(H2,23,25,27,30)/b12-9+ |
| InChIKey |
DVXWGGPLJHGRQK-FMIVXFBMSA-N |
| Molecular Weight |
424.450 g/mol |
| SMILES |
N(C(C=1C(=NOC1C)C=1C=CC=CC1)=O)NC(NC(\C=C\C=1C=CC(=CC1)F)=O)=S |
![(2E)-3-(4-fluorophenyl)-N-({2-[(5-methyl-3-phenyl-4-isoxazolyl)carbonyl]hydrazino}carbothioyl)-2-propenamide](/api/spectrum/3ox9nWvOq5r/structure.png?h=300&w=458 "(2E)-3-(4-fluorophenyl)-N-({2-[(5-methyl-3-phenyl-4-isoxazolyl)carbonyl]hydrazino}carbothioyl)-2-propenamide")
