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4-Amino-6-methyl-3-(methylthio)-1-phenyl-5-pyrazolo[3,4-b]pyridinecarboxylic acid methyl ester
SpectraBase Compound ID ZVnCiYLpG0
InChI InChI=1S/C16H16N4O2S/c1-9-11(16(21)22-2)13(17)12-14(18-9)20(19-15(12)23-3)10-7-5-4-6-8-10/h4-8H,1-3H3,(H2,17,18)
InChIKey CGPCAMDCYWCCBI-UHFFFAOYSA-N
Mol Weight 328.39 g/mol
Molecular Formula C16H16N4O2S
Exact Mass 328.099397 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KniQHG80m8T
Name 4-Amino-6-methyl-3-(methylthio)-1-phenyl-5-pyrazolo[3,4-b]pyridinecarboxylic acid methyl ester
Alternate Name(s) 4-Amino-6-methyl-3-(methylthio)-1-phenyl-pyrazolo[3,4-b]pyridine-5-carboxylic acid methyl ester Methyl 4-amino-6-methyl-3-(methylsulfanyl)-1-phenyl-1H-pyrazolo[3,4-b]pyridine-5-carboxylate Methyl 4-amino-6-methyl-3-methylsulfanyl-1-phenyl-pyrazolo[3,4-b]pyridine-5-carboxylate Methyl 4-azanyl-6-methyl-3-methylsulfanyl-1-phenyl-pyrazolo[3,4-b]pyridine-5-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H16N4O2S
InChI InChI=1S/C16H16N4O2S/c1-9-11(16(21)22-2)13(17)12-14(18-9)20(19-15(12)23-3)10-7-5-4-6-8-10/h4-8H,1-3H3,(H2,17,18)
InChIKey CGPCAMDCYWCCBI-UHFFFAOYSA-N
Molecular Weight 328.390 g/mol
SMILES Nc1c2c([n](nc2SC)-c2ccccc2)nc(c1C(=O)OC)C
SPLASH splash10-004i-1049000000-5c9003306835b9b7d692
Source of Spectrum CV-0-455-3
Wiley ID 872725