| SpectraBase Spectrum ID |
32GDAGhWyF8 |
| Name |
4-Methyl-2-methylthio-8-nitro-5-oxo-4,5-dihydro-1,4-benzodiazepine-3-carbonitrile |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H9N3O3S2 |
| InChI |
InChI=1S/C12H9N3O3S2/c1-14-9(6-13)12(19-2)20-10-5-7(15(17)18)3-4-8(10)11(14)16/h3-5H,1-2H3 |
| InChIKey |
YWAAFCQAGLHXNR-UHFFFAOYSA-N |
| Molecular Weight |
307.342 g/mol |
| SMILES |
C=1(N(C(c2ccc(N(=O)=O)cc2SC1SC)=O)C)C#N |
| SPLASH |
splash10-07xu-9485000000-8ef97159f18bba07d6b8 |
| Source of Spectrum |
Y-35-228-3 |
| Synonyms |
8-Methyl-6-methylsulfanyl-3-nitro-9-oxo-8,9-dihydro-5-thia-8-aza-benzocycloheptene-7-carbonitrile
4-Methyl-2-(methylthio)-8-nitro-5-oxo-1,4-benzothiazepine-3-carbonitrile
4-Methyl-2-methylsulfanyl-8-nitro-5-oxo-1,4-benzothiazepine-3-carbonitrile
4-Methyl-2-methylsulfanyl-8-nitro-5-oxidanylidene-1,4-benzothiazepine-3-carbonitrile |
| Wiley ID |
1308777 |
