| SpectraBase Spectrum ID |
Ls2GNfJIBSK |
| Name |
2-(4-Butoxyphenyl)-5,6,7,8-tetrahydro-3H-benzothiopheno[2,3-D]pyrimidin-4-one |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
354.140199128 u |
| Formula |
C20H22N2O2S |
| InChI |
InChI=1S/C20H22N2O2S/c1-2-3-12-24-14-10-8-13(9-11-14)18-21-19(23)17-15-6-4-5-7-16(15)25-20(17)22-18/h8-11H,2-7,12H2,1H3,(H,21,22,23) |
| InChIKey |
HQPFOBVNLVHDOW-UHFFFAOYSA-N |
| Molecular Weight |
354.468 g/mol |
| SMILES |
C12=C(SC=3CCCCC13)N=C(NC2=O)C1=CC=C(C=C1)OCCCC |
![2-(4-butoxyphenyl)-5,6,7,8-tetrahydro-3H-benzothiopheno[2,3-d]pyrimidin-4-one](/api/spectrum/Ls2GNfJIBSK/structure.png?h=300&w=458 "2-(4-butoxyphenyl)-5,6,7,8-tetrahydro-3H-benzothiopheno[2,3-d]pyrimidin-4-one")
