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6-(2-amino-2-oxo-ethyl)sulfanyl-5-cyano-4-(4-fluorophenyl)-2-methyl-N-(o-tolyl)pyridine-3-carboxamide
SpectraBase Compound ID AtSez3m1SFi
InChI InChI=1S/C23H19FN4O2S/c1-13-5-3-4-6-18(13)28-22(30)20-14(2)27-23(31-12-19(26)29)17(11-25)21(20)15-7-9-16(24)10-8-15/h3-10H,12H2,1-2H3,(H2,26,29)(H,28,30)
InChIKey VQKDNTOYVVXZCN-UHFFFAOYSA-N
Mol Weight 434.49 g/mol
Molecular Formula C23H19FN4O2S
Exact Mass 434.121275 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GI5nwXS49xQ
Name 6-(2-amino-2-oxo-ethyl)sulfanyl-5-cyano-4-(4-fluorophenyl)-2-methyl-N-(o-tolyl)pyridine-3-carboxamide
Alternate Name(s) 6-(2-amino-2-oxoethyl)sulfanyl-5-cyano-4-(4-fluorophenyl)-2-methyl-N-(2-methylphenyl)pyridine-3-carboxamide 6-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-5-cyano-4-(4-fluorophenyl)-2-methyl-N-(2-methylphenyl)pyridine-3-carboxamide 6-[(2-amino-2-keto-ethyl)thio]-5-cyano-4-(4-fluorophenyl)-2-methyl-N-(o-tolyl)nicotinamide 6-[(2-amino-2-oxoethyl)thio]-5-cyano-4-(4-fluorophenyl)-2-methyl-N-(2-methylphenyl)-3-pyridinecarboxamide
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Formula C23H19FN4O2S
InChI InChI=1S/C23H19FN4O2S/c1-13-5-3-4-6-18(13)28-22(30)20-14(2)27-23(31-12-19(26)29)17(11-25)21(20)15-7-9-16(24)10-8-15/h3-10H,12H2,1-2H3,(H2,26,29)(H,28,30)
InChIKey VQKDNTOYVVXZCN-UHFFFAOYSA-N
Molecular Weight 434.489 g/mol
SMILES NC(CSc1c(c(c(C(Nc2c(C)cccc2)=O)c(n1)C)-c1ccc(cc1)F)C#N)=O
SPLASH splash10-004i-5589100000-ce419df1012b160b9248
Wiley ID 1455035