| SpectraBase Spectrum ID |
GfjOnUyHJZW |
| Name |
(S)-2-(3-(5-Methyl-1-(p-tolyl)-1H-1,2,3-triazol-4-yl)-3-oxo-1-phenylpropyl)malononitrile |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
369.158960251 u |
| Formula |
C22H19N5O |
| InChI |
InChI=1S/C22H19N5O/c1-15-8-10-19(11-9-15)27-16(2)22(25-26-27)21(28)12-20(18(13-23)14-24)17-6-4-3-5-7-17/h3-11,18,20H,12H2,1-2H3/t20-/m1/s1 |
| InChIKey |
RMTMJIVDYADNOG-HXUWFJFHSA-N |
| Molecular Weight |
369.428 g/mol |
| SMILES |
C(C(C#N)[C@]([H])(CC(C1=C(C)N(C2=CC=C(C=C2)C)N=N1)=O)C1=CC=CC=C1)#N |
