SpectraBase Spectrum ID |
29mW87xPKKg |
Name |
[2-(5-Chloranylthiophen-2-yl)quinolin-4-yl]-(2-methylpiperidin-1-yl)methanone |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
370.090662113 u |
Formula |
C20H19ClN2OS |
InChI |
InChI=1S/C20H19ClN2OS/c1-13-6-4-5-11-23(13)20(24)15-12-17(18-9-10-19(21)25-18)22-16-8-3-2-7-14(15)16/h2-3,7-10,12-13H,4-6,11H2,1H3 |
InChIKey |
VTQSZOQEIPZKBR-UHFFFAOYSA-N |
Molecular Weight |
370.898 g/mol |
SMILES |
C1=C(C2=C(N=C1C1=CC=C(S1)Cl)C=CC=C2)C(N1C(CCCC1)C)=O |