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1-[2'-Benzothiazolyl]-3,5-dicyano-4-(4"-methoxyphenyl)-6-amino-2-pyridone
SpectraBase Compound ID 1VOV9toACFC
InChI InChI=1S/C21H13N5O2S/c1-28-13-8-6-12(7-9-13)18-14(10-22)19(24)26(20(27)15(18)11-23)21-25-16-4-2-3-5-17(16)29-21/h2-9H,24H2,1H3
InChIKey XNYZYYXLCRMBTM-UHFFFAOYSA-N
Mol Weight 399.43 g/mol
Molecular Formula C21H13N5O2S
Exact Mass 399.078996 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3GHnWr1XYu
Name 1-[2'-Benzothiazolyl]-3,5-dicyano-4-(4"-methoxyphenyl)-6-amino-2-pyridone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H13N5O2S
InChI InChI=1S/C21H13N5O2S/c1-28-13-8-6-12(7-9-13)18-14(10-22)19(24)26(20(27)15(18)11-23)21-25-16-4-2-3-5-17(16)29-21/h2-9H,24H2,1H3
InChIKey XNYZYYXLCRMBTM-UHFFFAOYSA-N
Molecular Weight 399.428 g/mol
SMILES NC1=C(C#N)C(=C(C(N1c1nc2ccccc2s1)=O)C#N)c1ccc(cc1)OC
SPLASH splash10-0002-0209100000-32dcc11a986a104e824b
Source of Spectrum G-60-1007-0
Synonyms 6-Amino-1-(1,3-benzothiazol-2-yl)-4-(4-methoxyphenyl)-2-oxo-1,2-dihydro-3,5-pyridinedicarbonitrile
Wiley ID 748889