| SpectraBase Spectrum ID |
CNpCQofWNBH |
| Name |
4-(4-CHLOROPHENYL)-8-METHYLTHIO-7-METHYL-2,3,6,7-TETRAHYDRO-1H-PYRIMIDO-[4,5-B]-[1,4]-DIAZEPIN-6-ONE |
| Compound Number |
3D |
| Copyright |
Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula |
C15H15ClN4OS |
| InChI |
InChI=1S/C15H15ClN4OS/c1-20-14(21)12-13(19-15(20)22-2)17-8-7-11(18-12)9-3-5-10(16)6-4-9/h3-6,17H,7-8H2,1-2H3 |
| InChIKey |
IPWHYSWTFJHHDE-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 |
334.823 g/mol |
| Solvent |
DMSO-D6 |
| Source File Reference |
UWCP8793 |
![4-(4-CHLOROPHENYL)-8-METHYLTHIO-7-METHYL-2,3,6,7-TETRAHYDRO-1H-PYRIMIDO-[4,5-B]-[1,4]-DIAZEPIN-6-ONE](/api/spectrum/CNpCQofWNBH/structure.png?h=300&w=458 "4-(4-CHLOROPHENYL)-8-METHYLTHIO-7-METHYL-2,3,6,7-TETRAHYDRO-1H-PYRIMIDO-[4,5-B]-[1,4]-DIAZEPIN-6-ONE")
