| SpectraBase Spectrum ID |
BJ8lVzY9AvL |
| Name |
(5E)-2-(4-Phenyl-1-piperazinyl)-5-[(4-propan-2-yloxyphenyl)methylidene]-4-thiazolone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
407.166748229 u |
| Formula |
C23H25N3O2S |
| InChI |
InChI=1S/C23H25N3O2S/c1-17(2)28-20-10-8-18(9-11-20)16-21-22(27)24-23(29-21)26-14-12-25(13-15-26)19-6-4-3-5-7-19/h3-11,16-17H,12-15H2,1-2H3/b21-16+ |
| InChIKey |
OULIXIYBRAXQNF-LTGZKZEYSA-N |
| Molecular Weight |
407.532 g/mol |
| SMILES |
C=1C=CC(N2CCN(C3=NC(\C(=C/C=4C=CC(OC(C)C)=CC4)S3)=O)CC2)=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.921893 |
![(5E)-2-(4-phenyl-1-piperazinyl)-5-[(4-propan-2-yloxyphenyl)methylidene]-4-thiazolone](/api/spectrum/BJ8lVzY9AvL/structure.png?h=300&w=458 "(5E)-2-(4-phenyl-1-piperazinyl)-5-[(4-propan-2-yloxyphenyl)methylidene]-4-thiazolone")
