| SpectraBase Spectrum ID |
2fhPWDz8T8u |
| Name |
1-[4-[(3,4-Dimethylisoxazol-5-yl)sulfamoyl]phenyl]-3-phenethyl-thiourea |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
430.113332929 u |
| Formula |
C20H22N4O3S2 |
| InChI |
InChI=1S/C20H22N4O3S2/c1-14-15(2)23-27-19(14)24-29(25,26)18-10-8-17(9-11-18)22-20(28)21-13-12-16-6-4-3-5-7-16/h3-11,24H,12-13H2,1-2H3,(H2,21,22,28) |
| InChIKey |
KRQPVTBTEFGZPF-UHFFFAOYSA-N |
| Molecular Weight |
430.541 g/mol |
| SMILES |
C=1C=CC(CCNC(NC2=CC=C(S(NC3=C(C(C)=NO3)C)(=O)=O)C=C2)=S)=CC1 |
![1-[4-[(3,4-Dimethylisoxazol-5-yl)sulfamoyl]phenyl]-3-phenethyl-thiourea](/api/spectrum/2fhPWDz8T8u/structure.png?h=300&w=458 "1-[4-[(3,4-Dimethylisoxazol-5-yl)sulfamoyl]phenyl]-3-phenethyl-thiourea")
