| SpectraBase Spectrum ID |
CQERe18dWuK |
| Name |
3,8,9-trimethyl-2-(methylthio)-6-phenyl-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(12-8-6-5-7-9-12)10-13-14(19(11)2)18-17(24-4)20(3)16(13)23/h5-9,11H,10H2,1-4H3 |
| InChIKey |
ONRGFWZHTVORSZ-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 |
C=1(N(C(C2=C(N1)N(C(C(N(C2)c1ccccc1)=O)C)C)=O)C)SC |
| SPLASH |
splash10-03di-2392000000-a9a024b842d035d7bc93 |
| Source of Spectrum |
AJC-12-SM129-11f |
| Wiley ID |
1857361 |
![3,8,9-trimethyl-2-(methylthio)-6-phenyl-5,6,8,9-tetrahydro-3H-pyrimido[4,5-e][1,4]diazepine-4,7-dione](/api/spectrum/CQERe18dWuK/structure.png?h=300&w=458 "3,8,9-trimethyl-2-(methylthio)-6-phenyl-5,6,8,9-tetrahydro-3H-pyrimido[4,5-e][1,4]diazepine-4,7-dione")
