SpectraBase Spectrum ID |
8df3UE50S4E |
Name |
2-Pyrrolidinecarboxamide, 1-[[4-(acetylamino)phenyl]sulfonyl]-N-(4-fluorophenyl)- |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
405.115855469 u |
Formula |
C19H20FN3O4S |
InChI |
InChI=1S/C19H20FN3O4S/c1-13(24)21-15-8-10-17(11-9-15)28(26,27)23-12-2-3-18(23)19(25)22-16-6-4-14(20)5-7-16/h4-11,18H,2-3,12H2,1H3,(H,21,24)(H,22,25) |
InChIKey |
QKYQVYSDLDANPR-UHFFFAOYSA-N |
Molecular Weight |
405.444 g/mol |
SMILES |
C1C(C(=O)NC2=CC=C(C=C2)F)N(CC1)S(=O)(=O)C=1C=CC(NC(=O)C)=CC1 |