| SpectraBase Spectrum ID |
4Nyj8v13MGj |
| Name |
3-Pyridinecarboxamide, 2-chloro-N-[2-[[[3-(4-morpholinyl)propyl]amino]carbonyl]phenyl]- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
402.145868314 u |
| Formula |
C20H23ClN4O3 |
| InChI |
InChI=1S/C20H23ClN4O3/c21-18-16(6-3-8-22-18)20(27)24-17-7-2-1-5-15(17)19(26)23-9-4-10-25-11-13-28-14-12-25/h1-3,5-8H,4,9-14H2,(H,23,26)(H,24,27) |
| InChIKey |
KUIAOMJYEHPIBN-UHFFFAOYSA-N |
| Molecular Weight |
402.882 g/mol |
| SMILES |
N(C(C=1C(=NC=CC1)Cl)=O)C=1C(C(=O)NCCCN2CCOCC2)=CC=CC1 |