4-[2-(2-Methyl-4(3H)-hydroxythieno[2,3-d]pyrimidin-5-yl)ethyl]benzoic acid

SpectraBase Compound ID	7cAw6pMWBn5
InChI	InChI=1S/C16H14N2O3S/c1-9-17-14(19)13-12(8-22-15(13)18-9)7-4-10-2-5-11(6-3-10)16(20)21/h2-3,5-6,8H,4,7H2,1H3,(H,20,21)(H,17,18,19)
InChIKey	XPWZGTWYCBJDSJ-UHFFFAOYSA-N Google Search
Mol Weight	314.36 g/mol
Molecular Formula	C16H14N2O3S
Exact Mass	314.072513 g/mol

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SpectraBase Spectrum ID	8ffz5Prrwxu
Name	4-[2-(2-Methyl-4(3H)-hydroxythieno[2,3-d]pyrimidin-5-yl)ethyl]benzoic acid
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C16H14N2O3S
InChI	InChI=1S/C16H14N2O3S/c1-9-17-14(19)13-12(8-22-15(13)18-9)7-4-10-2-5-11(6-3-10)16(20)21/h2-3,5-6,8H,4,7H2,1H3,(H,20,21)(H,17,18,19)
InChIKey	XPWZGTWYCBJDSJ-UHFFFAOYSA-N
Molecular Weight	314.359 g/mol
SMILES	Oc1nc(nc2c1c(CCc1ccc(C(=O)O)cc1)cs2)C
SPLASH	splash10-004i-0903000000-8726a1a5e7ca4abc0031
Source of Spectrum	H1-43-359-25
Synonyms	4-[2-(2-Methyl-4(3H)-oxothieno[2,3-d]pyrimidin-5-yl)ethyl]benzoic acid 4-[2-(2-Methyl-4-hydroxythieno[2,3-d]pyrimidin-5-yl)ethyl]benzoic acid 4-[2-(4-hydroxy-2-methylthieno[2,3-d]pyrimidin-5-yl)ethyl]benzoic acid
Wiley ID	757804