| SpectraBase Spectrum ID |
CVG3cnMWkmq |
| Name |
2-{[2-(Diethylamino)ethyl]sulfanyl}-3-(4-methylphenyl)-5,6,7,8-tetrahydro[1]benzothieno[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 |
427.175204913 u |
| Formula |
C23H29N3OS2 |
| InChI |
InChI=1S/C23H29N3OS2/c1-4-25(5-2)14-15-28-23-24-21-20(18-8-6-7-9-19(18)29-21)22(27)26(23)17-12-10-16(3)11-13-17/h10-13H,4-9,14-15H2,1-3H3 |
| InChIKey |
MJPXJRRCLPOYJM-UHFFFAOYSA-N |
| Molecular Weight |
427.625 g/mol |
| SMILES |
C12=C(N=C(N(C2=O)C2=CC=C(C=C2)C)SCCN(CC)CC)SC2=C1CCCC2 |
![2-{[2-(diethylamino)ethyl]sulfanyl}-3-(4-methylphenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one](/api/spectrum/CVG3cnMWkmq/structure.png?h=300&w=458 "2-{[2-(diethylamino)ethyl]sulfanyl}-3-(4-methylphenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one")
