N5-[1-Methyl-1-(4-methylphenyl)-1-oxo-λ6-sulfanylidene]-4-(isopropylthio)-1,3-dimethyl-1H-pyrazolo[3,4-b]pyridine-5-carboxamide
7046
Reference
N5-[1-Methyl-1-(4-methylphenyl)-1-oxo-λ6-sulfanylidene]-4-(isopropylthio)-1,3-dimethyl-1H-pyrazolo[3,4-b]pyridine-5-carboxamide Structure
Systematic / IUPAC Name: 4-(Isopropylsulfanyl)-1,3-dimethyl-N-[methyl(4-methylphenyl)oxido-λ6-sulfanylidene]-1H-pyrazolo[3,4-b]pyridine-5-carboxamide
ID: Reference7046
Other Names: 1H-Pyrazolo[3,4-b]pyridine-5-carboxamide, 1,3-dimethyl-4-[(1-methylethyl)thio]-N-[methyl(4-methylphenyl)oxidosulfanylidene]-
Formula: C20H24N4O2S2
Spectral Data
N5-[1-Methyl-1-(4-methylphenyl)-1-oxo-λ6-sulfanylidene]-4-(isopropylthio)-1,3-dimethyl-1H-pyrazolo[3,4-b]pyridine-5-carboxamide mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Available MS Data
| Used Instruments | Q Exactive Orbitrap |
| No. of Spectral Trees | 1 |
| No. of Spectra | 119 |
| Tandem Spectra | MS1, MS2 |
| Ionization Methods | ESI |
| Analyzers | FT |
| Last Modification | 11/21/2017 12:56:34 PM |
Identificators
| InChI | InChI=1S/C20H24N4O2S2/c1-12(2)27-18-16(11-21-19-17(18)14(4)22-24(19)5)20(25)23-28(6,26)15-9-7-13(3)8-10-15/h7-12H,1-6H3 |
| InChI Key | OMWOUIZTHKJPPJ-UHFFFAOYSA-N |
| Canonical SMILES | CC1=CC=C(C=C1)S(=NC(=O)C2=CN=C3C(=C2SC(C)C)C(=NN3C)C)(=O)C |
| CAS | |
| Splash | |
| Other Names | 1H-Pyrazolo[3,4-b]pyridine-5-carboxamide, 1,3-dimethyl-4-[(1-methylethyl)thio]-N-[methyl(4-methylphenyl)oxidosulfanylidene]- |