2-Amino-4-isopropyl-6-[2-oxo-2-(2-oxochromen-3-yl)ethyl]sulfanyl-pyridine-3,5-dicarbonitrile

SpectraBase Compound ID	3xumwaGXHkU
InChI	InChI=1S/C21H16N4O3S/c1-11(2)18-14(8-22)19(24)25-20(15(18)9-23)29-10-16(26)13-7-12-5-3-4-6-17(12)28-21(13)27/h3-7,11H,10H2,1-2H3,(H2,24,25)
InChIKey	HHCAFATZJAYVMW-UHFFFAOYSA-N Google Search
Mol Weight	404.44 g/mol
Molecular Formula	C21H16N4O3S
Exact Mass	404.094312 g/mol

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SpectraBase Spectrum ID	2ODflNNvAvr
Name	2-Amino-4-isopropyl-6-[2-oxo-2-(2-oxochromen-3-yl)ethyl]sulfanyl-pyridine-3,5-dicarbonitrile
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C21H16N4O3S
InChI	InChI=1S/C21H16N4O3S/c1-11(2)18-14(8-22)19(24)25-20(15(18)9-23)29-10-16(26)13-7-12-5-3-4-6-17(12)28-21(13)27/h3-7,11H,10H2,1-2H3,(H2,24,25)
InChIKey	HHCAFATZJAYVMW-UHFFFAOYSA-N
Molecular Weight	404.444 g/mol
SMILES	Nc1c(C#N)c(c(c(n1)SCC(C=1C(Oc2c(C1)cccc2)=O)=O)C#N)C(C)C
SPLASH	splash10-00di-7910000000-443f60a6c82c72d941d8
Synonyms	2-Amino-4-isopropyl-6-[[2-keto-2-(2-ketochromen-3-yl)ethyl]thio]dinicotinonitrile 2-Amino-6-[2-oxo-2-(2-oxochromen-3-yl)ethyl]sulfanyl-4-propan-2-ylpyridine-3,5-dicarbonitrile 2-Amino-6-[[2-oxo-2-(2-oxo-1-benzopyran-3-yl)ethyl]thio]-4-propan-2-ylpyridine-3,5-dicarbonitrile 2-Azanyl-6-[2-oxidanylidene-2-(2-oxidanylidenechromen-3-yl)ethyl]sulfanyl-4-propan-2-yl-pyridine-3,5-dicarbonitrile
Wiley ID	1464914