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Dimethyl 5-([2-methoxy-4-(methylsulfanyl)benzoyl]amino)isophthalate
SpectraBase Compound ID 4LwAiZX1ryr
InChI InChI=1S/C19H19NO6S/c1-24-16-10-14(27-4)5-6-15(16)17(21)20-13-8-11(18(22)25-2)7-12(9-13)19(23)26-3/h5-10H,1-4H3,(H,20,21)
InChIKey PGDGLWRFRIODSF-UHFFFAOYSA-N
Mol Weight 389.42 g/mol
Molecular Formula C19H19NO6S
Exact Mass 389.093309 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IxU1kKyyCaW
Name Dimethyl 5-([2-methoxy-4-(methylsulfanyl)benzoyl]amino)isophthalate
CAS Registry Number 345993-17-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H19NO6S
InChI InChI=1S/C19H19NO6S/c1-24-16-10-14(27-4)5-6-15(16)17(21)20-13-8-11(18(22)25-2)7-12(9-13)19(23)26-3/h5-10H,1-4H3,(H,20,21)
InChIKey PGDGLWRFRIODSF-UHFFFAOYSA-N
Molecular Weight 389.422 g/mol
SMILES N(C(c1c(cc(cc1)SC)OC)=O)c1cc(C(=O)OC)cc(c1)C(=O)OC
SPLASH splash10-001i-1902000000-6d046167462680ee248b
Source of Spectrum AD-0-2532-0
Synonyms 5-[[2-methoxy-4-(methylthio)benzoyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester 5-[[[2-methoxy-4-(methylthio)phenyl]-oxomethyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester Benzene-1,3-dicarboxylic acid, 5-(2-methoxy-4-methylthiobenzoylamino)-, dimethyl ester Dimethyl 5-[(2-methoxy-4-methylsulfanyl-benzoyl)amino]benzene-1,3-dicarboxylate Dimethyl 5-[(2-methoxy-4-methylsulfanyl-phenyl)carbonylamino]benzene-1,3-dicarboxylate
Wiley ID 1432911