1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(4-chlorophenyl)sulfonylmethyl]-4-triazolecarboxylic acid ethyl ester

SpectraBase Compound ID	FwDOMyEJLkw
InChI	InChI=1S/C14H13ClN6O5S/c1-2-25-14(22)11-10(21(20-17-11)13-12(16)18-26-19-13)7-27(23,24)9-5-3-8(15)4-6-9/h3-6H,2,7H2,1H3,(H2,16,18)
InChIKey	WMOOOVYOGQGBAX-UHFFFAOYSA-N Google Search
Mol Weight	412.81 g/mol
Molecular Formula	C14H13ClN6O5S
Exact Mass	412.035666 g/mol

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SpectraBase Spectrum ID	5Vvl4HJ0xbC
Name	1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(4-chlorophenyl)sulfonylmethyl]-4-triazolecarboxylic acid ethyl ester
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C14H13ClN6O5S
InChI	InChI=1S/C14H13ClN6O5S/c1-2-25-14(22)11-10(21(20-17-11)13-12(16)18-26-19-13)7-27(23,24)9-5-3-8(15)4-6-9/h3-6H,2,7H2,1H3,(H2,16,18)
InChIKey	WMOOOVYOGQGBAX-UHFFFAOYSA-N
Molecular Weight	412.808 g/mol
SMILES	Nc1nonc1-[n]1c(c(nn1)C(OCC)=O)CS(=O)(=O)c1ccc(cc1)Cl
SPLASH	splash10-08fr-6900000000-8e3222bd3be69f1954b7
Synonyms	1-(4-aminofurazan-3-yl)-5-[(4-chlorophenyl)sulfonylmethyl]triazole-4-carboxylic acid ethyl ester Ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(4-chlorophenyl)sulfonylmethyl]triazole-4-carboxylate Ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[(4-chlorophenyl)sulfonyl]methyl}-1H-1,2,3-triazole-4-carboxylate Ethyl 1-(4-azanyl-1,2,5-oxadiazol-3-yl)-5-[(4-chlorophenyl)sulfonylmethyl]-1,2,3-triazole-4-carboxylate
Wiley ID	1512437