| SpectraBase Spectrum ID |
15skm2EKB5r |
| Name |
4-[4-(3,4-Dichlorobenzyl)-1-piperazinyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-D]pyrimidine |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
432.094223298 u |
| Formula |
C21H22Cl2N4S |
| InChI |
InChI=1S/C21H22Cl2N4S/c22-16-6-5-14(11-17(16)23)12-26-7-9-27(10-8-26)20-19-15-3-1-2-4-18(15)28-21(19)25-13-24-20/h5-6,11,13H,1-4,7-10,12H2 |
| InChIKey |
JVRAJKKUBGAXMB-UHFFFAOYSA-N |
| Molecular Weight |
433.401 g/mol |
| SMILES |
C12=C(SC3=C2CCCC3)N=CN=C1N1CCN(CC1)CC=1C=C(Cl)C(=CC1)Cl |
![4-[4-(3,4-Dichlorobenzyl)-1-piperazinyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-D]pyrimidine](/api/spectrum/15skm2EKB5r/structure.png?h=300&w=458 "4-[4-(3,4-Dichlorobenzyl)-1-piperazinyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-D]pyrimidine")
