| SpectraBase Spectrum ID |
IpVHbulePli |
| Name |
6-Benzyl-3-methyl-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 |
C16H18N4O2S |
| InChI |
InChI=1S/C16H18N4O2S/c1-19-15(22)12-10-20(9-11-6-4-3-5-7-11)13(21)8-17-14(12)18-16(19)23-2/h3-7,17H,8-10H2,1-2H3 |
| InChIKey |
WMXMJHLXMVAWHQ-UHFFFAOYSA-N |
| Instrument Name |
SHIMADZU 2010-DI-2010 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1016/j.arabjc.2016.07.012 |
| Molecular Weight |
330.406 g/mol |
| Reported Formula |
C16H18N4O2S |
| SMILES |
N1CC(N(CC=2C(N(C(=NC12)SC)C)=O)Cc1ccccc1)=O |
| SPLASH |
splash10-000j-5951000000-1f45869d4fd5e699cb1b |
| Source of Spectrum |
AJC-12-SM121-8q |
| Wiley ID |
1857407 |
![6-Benzyl-3-methyl-2-(methylthio)-5,6,8,9-tetrahydro-3H-pyrimido[4,5-e][1,4]diazepine-4,7-dione](/api/spectrum/IpVHbulePli/structure.png?h=300&w=458 "6-Benzyl-3-methyl-2-(methylthio)-5,6,8,9-tetrahydro-3H-pyrimido[4,5-e][1,4]diazepine-4,7-dione")
