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4-(1-isopropyl-2-thioxo-3-pyridyl)-2-keto-6-(4-methoxyphenyl)-1H-pyridine-3-carbonitrile
SpectraBase Compound ID 56Ej9ZAQtwE
InChI InChI=1S/C21H19N3O2S/c1-13(2)24-10-4-5-16(21(24)27)17-11-19(23-20(25)18(17)12-22)14-6-8-15(26-3)9-7-14/h4-11,13H,1-3H3,(H,23,25)
InChIKey XKNUXRBQHUTMHB-UHFFFAOYSA-N
Mol Weight 377.46 g/mol
Molecular Formula C21H19N3O2S
Exact Mass 377.119798 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3pWU4SeL80b
Name 4-(1-isopropyl-2-thioxo-3-pyridyl)-2-keto-6-(4-methoxyphenyl)-1H-pyridine-3-carbonitrile
CAS Registry Number 89818-10-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H19N3O2S
InChI InChI=1S/C21H19N3O2S/c1-13(2)24-10-4-5-16(21(24)27)17-11-19(23-20(25)18(17)12-22)14-6-8-15(26-3)9-7-14/h4-11,13H,1-3H3,(H,23,25)
InChIKey XKNUXRBQHUTMHB-UHFFFAOYSA-N
Molecular Weight 377.462 g/mol
SMILES N1C(C(=C(C=C1c1ccc(cc1)OC)C=1C(N(C(C)C)C=CC1)=S)C#N)=O
SPLASH splash10-004i-0009000000-5d72fef7ca4cee546e88
Source of Spectrum Y-20-1654-0
Synonyms 4-(1-isopropyl-2-thioxo-3-pyridyl)-6-(4-methoxyphenyl)-2-oxo-1H-pyridine-3-carbonitrile 6-(4-Methoxyphenyl)-2-oxidanylidene-4-(1-propan-2-yl-2-sulfanylidene-pyridin-3-yl)-1H-pyridine-3-carbonitrile 6-(4-Methoxyphenyl)-2-oxo-4-(1-propan-2-yl-2-sulfanylidene-3-pyridinyl)-1H-pyridine-3-carbonitrile 6-(4-Methoxyphenyl)-2-oxo-4-(1-propan-2-yl-2-sulfanylidenepyridin-3-yl)-1H-pyridine-3-carbonitrile
Wiley ID 1358261