| SpectraBase Spectrum ID |
5P8zgLnXtzp |
| Name |
(S)-1-((4-Chlorobenzoyl)-L-prolyl)-N-(pyridin-2-ylmethyl)pyrrolidine-2-carboxamide |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
440.161518378 u |
| Formula |
C23H25ClN4O3 |
| InChI |
InChI=1S/C23H25ClN4O3/c24-17-10-8-16(9-11-17)22(30)28-14-4-7-20(28)23(31)27-13-3-6-19(27)21(29)26-15-18-5-1-2-12-25-18/h1-2,5,8-12,19-20H,3-4,6-7,13-15H2,(H,26,29)/t19-,20-/m0/s1 |
| InChIKey |
ASEGXDUKGMRJQM-PMACEKPBSA-N |
| Molecular Weight |
440.931 g/mol |
| SMILES |
[C@]1(N(CCC1)C([C@]1(N(CCC1)C(C1=CC=C(C=C1)Cl)=O)[H])=O)(C(=O)NCC1=CC=CC=N1)[H] |
