| SpectraBase Spectrum ID |
2SzYVjILJwm |
| Name |
(2E)-2-[(5E)-5-(2-Chlorobenzylidene)-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]-2-cyano-N-(4-isopropylphenyl)ethanamide |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
499.112125832 u |
| Formula |
C28H22ClN3O2S |
| InChI |
InChI=1S/C28H22ClN3O2S/c1-18(2)19-12-14-21(15-13-19)31-26(33)23(17-30)28-32(22-9-4-3-5-10-22)27(34)25(35-28)16-20-8-6-7-11-24(20)29/h3-16,18H,1-2H3,(H,31,33)/b25-16+,28-23+ |
| InChIKey |
INQUQPKLYCBQCU-QUTFRIDHSA-N |
| Molecular Weight |
500.016 g/mol |
| SMILES |
N(C(\C(=C/1N(C(=O)\C(S1)=C/C=1C(Cl)=CC=CC1)C=1C=CC=CC1)C#N)=O)C=1C=CC(=CC1)C(C)C |
![(2E)-2-[(5E)-5-(2-chlorobenzylidene)-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]-2-cyano-N-(4-isopropylphenyl)ethanamide](/api/spectrum/2SzYVjILJwm/structure.png?h=300&w=458 "(2E)-2-[(5E)-5-(2-chlorobenzylidene)-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]-2-cyano-N-(4-isopropylphenyl)ethanamide")
