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5(4H)-Oxazolone, 4-[[6-methoxy-2-[(4-methylphenyl)thio]-3-quinolinyl]methylidene]-2-(4-methoxyphenyl)-
SpectraBase Compound ID ADNl9Q4rxtj
InChI InChI=1S/C28H22N2O4S/c1-17-4-11-23(12-5-17)35-27-20(14-19-15-22(33-3)10-13-24(19)30-27)16-25-28(31)34-26(29-25)18-6-8-21(32-2)9-7-18/h4-16H,1-3H3/b25-16+
InChIKey VIKQWFGDXWDVDM-PCLIKHOPSA-N
Mol Weight 482.55 g/mol
Molecular Formula C28H22N2O4S
Exact Mass 482.130028 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4u8ftZWy4ad
Name 5(4H)-Oxazolone, 4-[[6-methoxy-2-[(4-methylphenyl)thio]-3-quinolinyl]methylidene]-2-(4-methoxyphenyl)-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H22N2O4S
InChI InChI=1S/C28H22N2O4S/c1-17-4-11-23(12-5-17)35-27-20(14-19-15-22(33-3)10-13-24(19)30-27)16-25-28(31)34-26(29-25)18-6-8-21(32-2)9-7-18/h4-16H,1-3H3/b25-16+
InChIKey VIKQWFGDXWDVDM-PCLIKHOPSA-N
Molecular Weight 482.554 g/mol
SMILES c1(ccc2c(c1)cc(c(n2)Sc1ccc(cc1)C)\C=C/1N=C(OC1=O)c1ccc(cc1)OC)OC
SPLASH splash10-000i-4932100000-51a55c9a60739bf31409
Source of Spectrum IY-1-4495-9
Synonyms (4E)-4-[[6-methoxy-2-[(4-methylphenyl)thio]-3-quinolinyl]methylidene]-2-(4-methoxyphenyl)-5-oxazolone (4E)-4-[[6-methoxy-2-(4-methylphenyl)sulfanylquinolin-3-yl]methylidene]-2-(4-methoxyphenyl)-1,3-oxazol-5-one (4E)-2-(4-methoxyphenyl)-4-[[6-methoxy-2-(p-tolylsulfanyl)-3-quinolyl]methylene]oxazol-5-one (4E)-4-[[6-methoxy-2-(4-methylphenyl)sulfanyl-quinolin-3-yl]methylidene]-2-(4-methoxyphenyl)-1,3-oxazol-5-one
Wiley ID 1652942