| SpectraBase Spectrum ID |
JZZYFHKHCNg |
| Name |
2-(Benzylsulfanyl)-3-phenyl-7-propyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-D]pyrimidin-4(3H)-one |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
447.143904784 u |
| Formula |
C25H25N3OS2 |
| InChI |
InChI=1S/C25H25N3OS2/c1-2-14-27-15-13-20-21(16-27)31-23-22(20)24(29)28(19-11-7-4-8-12-19)25(26-23)30-17-18-9-5-3-6-10-18/h3-12H,2,13-17H2,1H3 |
| InChIKey |
GDYIERLYIWJAAX-UHFFFAOYSA-N |
| Molecular Weight |
447.615 g/mol |
| SMILES |
C12=C(N=C(N(C2=O)C=2C=CC=CC2)SCC2=CC=CC=C2)SC2=C1CCN(CCC)C2 |
![2-(benzylsulfanyl)-3-phenyl-7-propyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one](/api/spectrum/JZZYFHKHCNg/structure.png?h=300&w=458 "2-(benzylsulfanyl)-3-phenyl-7-propyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one")
