4-(dimethylaminomethyl)-5-hydroxy-2-[(4-methylphenyl)sulfanylmethyl]-1-benzofuran-3-carboxylic acid

SpectraBase Compound ID	C0sUmlqkl7c
InChI	InChI=1S/C20H21NO4S/c1-12-4-6-13(7-5-12)26-11-17-19(20(23)24)18-14(10-21(2)3)15(22)8-9-16(18)25-17/h4-9,22H,10-11H2,1-3H3,(H,23,24)
InChIKey	AMOKQPNAQYXGGV-UHFFFAOYSA-N Google Search
Mol Weight	371.45 g/mol
Molecular Formula	C20H21NO4S
Exact Mass	371.119129 g/mol

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SpectraBase Spectrum ID	CWzVqmmB6Kl
Name	4-(dimethylaminomethyl)-5-hydroxy-2-[(4-methylphenyl)sulfanylmethyl]-1-benzofuran-3-carboxylic acid
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C20H21NO4S
InChI	InChI=1S/C20H21NO4S/c1-12-4-6-13(7-5-12)26-11-17-19(20(23)24)18-14(10-21(2)3)15(22)8-9-16(18)25-17/h4-9,22H,10-11H2,1-3H3,(H,23,24)
InChIKey	AMOKQPNAQYXGGV-UHFFFAOYSA-N
Molecular Weight	371.451 g/mol
SMILES	Oc1c(c2c(C(=O)O)c(oc2cc1)CSc1ccc(cc1)C)CN(C)C
SPLASH	splash10-0006-9310000000-098ab0efad527f8ab13b
Synonyms	4-[(dimethylazaniumyl)methyl]-5-hydroxy-2-[(4-methylphenyl)sulfanylmethyl]-1-benzofuran-3-carboxylate 4-[(dimethylamino)methyl]-5-hydroxy-2-[[(4-methylphenyl)thio]methyl]-3-benzofurancarboxylic acid 4-[(dimethylamino)methyl]-5-hydroxy-2-[(4-methylphenyl)sulfanylmethyl]-1-benzofuran-3-carboxylic acid 4-[(dimethylamino)methyl]-5-hydroxy-2-(p-tolylsulfanylmethyl)benzofuran-3-carboxylic acid 4-[(dimethylamino)methyl]-2-[(4-methylphenyl)sulfanylmethyl]-5-oxidanyl-1-benzofuran-3-carboxylic acid
Wiley ID	1442754