| SpectraBase Spectrum ID |
2CTt8fpcLIY |
| Name |
1H-Pyrazole-5-carboxamide, N-[2-[[(4-chlorophenyl)amino]carbonyl]phenyl]-1-methyl-3-propyl- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
396.135303630 u |
| Formula |
C21H21ClN4O2 |
| InChI |
InChI=1S/C21H21ClN4O2/c1-3-6-16-13-19(26(2)25-16)21(28)24-18-8-5-4-7-17(18)20(27)23-15-11-9-14(22)10-12-15/h4-5,7-13H,3,6H2,1-2H3,(H,23,27)(H,24,28) |
| InChIKey |
QAEMVNUVHNRNMM-UHFFFAOYSA-N |
| Molecular Weight |
396.878 g/mol |
| SMILES |
C=1(N(C)N=C(C1)CCC)C(NC=1C(C(NC2=CC=C(C=C2)Cl)=O)=CC=CC1)=O |
![1H-Pyrazole-5-carboxamide, N-[2-[[(4-chlorophenyl)amino]carbonyl]phenyl]-1-methyl-3-propyl-](/api/spectrum/2CTt8fpcLIY/structure.png?h=300&w=458 "1H-Pyrazole-5-carboxamide, N-[2-[[(4-chlorophenyl)amino]carbonyl]phenyl]-1-methyl-3-propyl-")
