| SpectraBase Spectrum ID |
60VNyddlYmb |
| Name |
2,3,6,7-Tetrahydro-8-methylthio-7-methyl-4-(4'-nitrophenyl)-2-phenyl-1H-pyrimodo[4,5-b]-[1,4]-diazepin-6-one |
| Alternate Name(s) |
3-Methyl-2-methylsulfanyl-6-(4-nitrophenyl)-8-phenyl-8,9-dihydro-7H-pyrimido[4,5-b][1,4]diazepin-4-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H19N5O3S |
| InChI |
InChI=1S/C21H19N5O3S/c1-25-20(27)18-19(24-21(25)30-2)23-17(13-6-4-3-5-7-13)12-16(22-18)14-8-10-15(11-9-14)26(28)29/h3-11,17,23H,12H2,1-2H3 |
| InChIKey |
WSASOTZFWHBMOA-UHFFFAOYSA-N |
| Molecular Weight |
421.475 g/mol |
| SMILES |
N1C(CC(=NC2=C1N=C(N(C2=O)C)SC)c1ccc(N(=O)=O)cc1)c1ccccc1 |
| SPLASH |
splash10-00di-3210900000-8feabe4afb909a365234 |
| Source of Spectrum |
Y-31-64-3 |
| Wiley ID |
761442 |
![2,3,6,7-TETRAHYDRO-7-METHYL-8-METHYLTHIO-4-(4-NITROPHENYL)-2-PHENYL-1H-PYRIMIDO-[4,5-B]-[1,4]-DIAZEPIN-6-ONE](/api/spectrum/60VNyddlYmb/structure.png?h=300&w=458 "2,3,6,7-TETRAHYDRO-7-METHYL-8-METHYLTHIO-4-(4-NITROPHENYL)-2-PHENYL-1H-PYRIMIDO-[4,5-B]-[1,4]-DIAZEPIN-6-ONE")
