2,4-Thiophenedicarboxylic acid, 5-[[2-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)acetyl]amino]-3-methyl-, diethyl ester

SpectraBase Compound ID	5PY1poQQYs2
InChI	InChI=1S/C18H22ClN3O5S/c1-6-26-17(24)13-9(3)15(18(25)27-7-2)28-16(13)20-12(23)8-22-11(5)14(19)10(4)21-22/h6-8H2,1-5H3,(H,20,23)
InChIKey	HLUQHLHKASLTPI-UHFFFAOYSA-N Google Search
Mol Weight	427.9 g/mol
Molecular Formula	C18H22ClN3O5S
Exact Mass	427.09687 g/mol

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SpectraBase Spectrum ID	4sz4faiWRMQ
Name	2,4-Thiophenedicarboxylic acid, 5-[[2-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)acetyl]amino]-3-methyl-, diethyl ester
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C18H22ClN3O5S
InChI	InChI=1S/C18H22ClN3O5S/c1-6-26-17(24)13-9(3)15(18(25)27-7-2)28-16(13)20-12(23)8-22-11(5)14(19)10(4)21-22/h6-8H2,1-5H3,(H,20,23)
InChIKey	HLUQHLHKASLTPI-UHFFFAOYSA-N
Molecular Weight	427.903 g/mol
SMILES	N(C(=O)C[n]1nc(c(c1C)Cl)C)c1sc(c(c1C(OCC)=O)C)C(OCC)=O
SPLASH	splash10-0006-2910100000-f5225c1c8d12f18a6854
Source of Spectrum	IY-1-4619-4
Synonyms	5-[[2-(4-chloro-3,5-dimethyl-1-pyrazolyl)-1-oxoethyl]amino]-3-methylthiophene-2,4-dicarboxylic acid diethyl ester Diethyl 5-[[2-(4-chloro-3,5-dimethylpyrazol-1-yl)acetyl]amino]-3-methylthiophene-2,4-dicarboxylate Diethyl 5-[[2-(4-chloro-3,5-dimethyl-pyrazol-1-yl)acetyl]amino]-3-methyl-thiophene-2,4-dicarboxylate Diethyl 5-[2-(4-chloranyl-3,5-dimethyl-pyrazol-1-yl)ethanoylamino]-3-methyl-thiophene-2,4-dicarboxylate
Wiley ID	1654177