| SpectraBase Spectrum ID |
9f3HzKJajyT |
| Name |
4H-Cyclopenta[4,5]thieno[2,3-D]pyrimidin-4-one, 3,5,6,7-tetrahydro-2-[[2-(4-methoxyphenyl)-2-oxoethyl]thio]-3-phenyl- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
448.091534857 u |
| Formula |
C24H20N2O3S2 |
| InChI |
InChI=1S/C24H20N2O3S2/c1-29-17-12-10-15(11-13-17)19(27)14-30-24-25-22-21(18-8-5-9-20(18)31-22)23(28)26(24)16-6-3-2-4-7-16/h2-4,6-7,10-13H,5,8-9,14H2,1H3 |
| InChIKey |
ULVLRNXWUZQHSC-UHFFFAOYSA-N |
| Molecular Weight |
448.555 g/mol |
| SMILES |
C12=C(N=C(N(C2=O)C=2C=CC=CC2)SCC(C2=CC=C(C=C2)OC)=O)SC2=C1CCC2 |
![4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one, 3,5,6,7-tetrahydro-2-[[2-(4-methoxyphenyl)-2-oxoethyl]thio]-3-phenyl-](/api/spectrum/9f3HzKJajyT/structure.png?h=300&w=458 "4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one, 3,5,6,7-tetrahydro-2-[[2-(4-methoxyphenyl)-2-oxoethyl]thio]-3-phenyl-")
