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4-[3,5-dicyano-6-mercapto-4-(4-methoxyphenyl)-2-oxopyridin-1(2H)-yl]-N-(3,4-dimethylisoxazol-5-yl)benzenesulfonamide
SpectraBase Compound ID IMzNwEbxB6c
InChI InChI=1S/C25H19N5O5S2/c1-14-15(2)28-35-23(14)29-37(32,33)19-10-6-17(7-11-19)30-24(31)20(12-26)22(21(13-27)25(30)36)16-4-8-18(34-3)9-5-16/h4-11,29,36H,1-3H3
InChIKey SLAYETPBNVWXAZ-UHFFFAOYSA-N
Mol Weight 533.58 g/mol
Molecular Formula C25H19N5O5S2
Exact Mass 533.082761 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ev1i9NSAPCb
Name 4-[3,5-dicyano-6-mercapto-4-(4-methoxyphenyl)-2-oxopyridin-1(2H)-yl]-N-(3,4-dimethylisoxazol-5-yl)benzenesulfonamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H19N5O5S2
InChI InChI=1S/C25H19N5O5S2/c1-14-15(2)28-35-23(14)29-37(32,33)19-10-6-17(7-11-19)30-24(31)20(12-26)22(21(13-27)25(30)36)16-4-8-18(34-3)9-5-16/h4-11,29,36H,1-3H3
InChIKey SLAYETPBNVWXAZ-UHFFFAOYSA-N
Molecular Weight 533.577 g/mol
SMILES N(c1c(c(C)no1)C)S(c1ccc(N2C(C(=C(C(=C2S)C#N)c2ccc(cc2)OC)C#N)=O)cc1)(=O)=O
SPLASH splash10-0a4i-9100000000-84179144dda3026ea65b
Source of Spectrum EMC-84-503-16a
Synonyms 4-(3,5-dicyano-6-mercapto-4-(4-methoxyphenyl)-2-oxopyridin-1(2H)-yl)-N-(3,4-dimethylisoxazol-5-yl)benzenesulfonamide
Wiley ID 1740160