| SpectraBase Spectrum ID |
3GH4d8bzmcK |
| Name |
6-Benzyl-3,8-dimethyl-2-(methylthio)-5,6,8,9-tetrahydro-3H-pyrimido[4,5-e][1,4]diazepine-4,7-dione |
| Appearance |
Colourless solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H20N4O2S |
| InChI |
InChI=1S/C17H20N4O2S/c1-11-15(22)21(9-12-7-5-4-6-8-12)10-13-14(18-11)19-17(24-3)20(2)16(13)23/h4-8,11,18H,9-10H2,1-3H3 |
| InChIKey |
CJZTYTXXTXGKNJ-UHFFFAOYSA-N |
| Instrument Name |
SHIMADZU 2010-DI-2010 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1016/j.arabjc.2016.07.012 |
| Molecular Weight |
344.433 g/mol |
| Reported Formula |
C17H20N4O2S |
| SMILES |
N1C(C(N(CC=2C(N(C(=NC12)SC)C)=O)Cc1ccccc1)=O)C |
| SPLASH |
splash10-0ikm-3892000000-404642e3369bb56aa64f |
| Source of Spectrum |
AJC-12-SM121-8r |
| Wiley ID |
1857408 |
![6-Benzyl-3,8-dimethyl-2-(methylthio)-5,6,8,9-tetrahydro-3H-pyrimido[4,5-e][1,4]diazepine-4,7-dione](/api/spectrum/3GH4d8bzmcK/structure.png?h=300&w=458 "6-Benzyl-3,8-dimethyl-2-(methylthio)-5,6,8,9-tetrahydro-3H-pyrimido[4,5-e][1,4]diazepine-4,7-dione")
