| SpectraBase Spectrum ID |
71ANppcbA7c |
| Name |
4-(4-CHLOROPHENYL)-8-METHYLTHIO-2,3,6,7-TETRAHYDRO-1H-PYRIMIDO-[4,5-B]-[1,4]-DIAZEPIN-6-ONE |
| Compound Number |
3B |
| Copyright |
Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula |
C14H13ClN4OS |
| InChI |
InChI=1S/C14H13ClN4OS/c1-21-14-18-12-11(13(20)19-14)17-10(6-7-16-12)8-2-4-9(15)5-3-8/h2-5H,6-7H2,1H3,(H2,16,18,19,20) |
| InChIKey |
BOUCBFCGXACUOX-UHFFFAOYSA-N |
| Literature Reference Author |
B.INSUASTY,J.C.ARGOTI,S.GOMEZ,J.QUIROGA,R.MARTINEZ,E.ANGELES
,R.GABINO,M.NOGUERAS |
| Literature Reference Citation |
J.HETCYCL.CHEM.,35,1397(1998) |
| Literature Reference DOI |
10.1002/jhet.5570350629 |
| Molecular Weight |
320.796 g/mol |
| Solvent |
DMSO-D6 |
| Source File Reference |
UWCP8791 |
![4-(4-CHLOROPHENYL)-8-METHYLTHIO-2,3,6,7-TETRAHYDRO-1H-PYRIMIDO-[4,5-B]-[1,4]-DIAZEPIN-6-ONE](/api/spectrum/71ANppcbA7c/structure.png?h=300&w=458 "4-(4-CHLOROPHENYL)-8-METHYLTHIO-2,3,6,7-TETRAHYDRO-1H-PYRIMIDO-[4,5-B]-[1,4]-DIAZEPIN-6-ONE")
