SpectraBase Spectrum ID |
AhUOc3EnCjq |
Name |
N-Benzyl-4-[(5Z)-5-(4-methylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-N-phenylbutanamide |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
486.143570431 u |
Formula |
C28H26N2O2S2 |
InChI |
InChI=1S/C28H26N2O2S2/c1-21-14-16-22(17-15-21)19-25-27(32)29(28(33)34-25)18-8-13-26(31)30(24-11-6-3-7-12-24)20-23-9-4-2-5-10-23/h2-7,9-12,14-17,19H,8,13,18,20H2,1H3/b25-19- |
InChIKey |
GPWFGCPBHPIKSW-PLRJNAJWSA-N |
Molecular Weight |
486.648 g/mol |
SMILES |
C1=CC=C(N(C(CCCN2C(S\C(C2=O)=C\C2=CC=C(C=C2)C)=S)=O)CC2=CC=CC=C2)C=C1 |