| SpectraBase Spectrum ID |
4ppIycX83GG |
| Name |
Ethyl (2Z)-2-{3-[(2,3-dimethylphenoxy)methyl]-4-methoxybenzylidene}-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-A]pyrimidine-6-carboxylate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
568.203193307 u |
| Formula |
C33H32N2O5S |
| InChI |
InChI=1S/C33H32N2O5S/c1-6-39-32(37)29-22(4)34-33-35(30(29)24-12-8-7-9-13-24)31(36)28(41-33)18-23-15-16-27(38-5)25(17-23)19-40-26-14-10-11-20(2)21(26)3/h7-18,30H,6,19H2,1-5H3/b28-18- |
| InChIKey |
IIVDGOPOYSASKY-VEILYXNESA-N |
| Molecular Weight |
568.688 g/mol |
| SMILES |
C1=2N(C(C(=C(N2)C)C(=O)OCC)C=2C=CC=CC2)C(\C(S1)=C\C=1C=C(COC=2C(=C(C)C=CC2)C)C(=CC1)OC)=O |