| SpectraBase Spectrum ID |
3Esht3UPsh1 |
| Name |
(2E)-6-Acetyl-2-[4-(dimethylamino)benzylidene]-5-(4-methoxyphenyl)-7-methyl-5H-[1,3]thiazolo[3,2-A]pyrimidin-3(2H)-one |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
447.161662848 u |
| Formula |
C25H25N3O3S |
| InChI |
InChI=1S/C25H25N3O3S/c1-15-22(16(2)29)23(18-8-12-20(31-5)13-9-18)28-24(30)21(32-25(28)26-15)14-17-6-10-19(11-7-17)27(3)4/h6-14,23H,1-5H3/b21-14+ |
| InChIKey |
JQCFQCJNEPGOPV-KGENOOAVSA-N |
| Molecular Weight |
447.553 g/mol |
| SMILES |
COC=1C=CC(C2C(=C(C)N=C3N2C(\C(=C/C2=CC=C(C=C2)N(C)C)S3)=O)C(=O)C)=CC1 |
![(2E)-6-acetyl-2-[4-(dimethylamino)benzylidene]-5-(4-methoxyphenyl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidin-3(2H)-one](/api/spectrum/3Esht3UPsh1/structure.png?h=300&w=458 "(2E)-6-acetyl-2-[4-(dimethylamino)benzylidene]-5-(4-methoxyphenyl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidin-3(2H)-one")
