1H-1,2,3-triazole-4-carboxylic acid, 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(4-phenyl-1-piperazinyl)methyl]-, ethyl ester

SpectraBase Compound ID	CmxflCkhESH
InChI	InChI=1S/C18H22N8O3/c1-2-28-18(27)15-14(26(23-20-15)17-16(19)21-29-22-17)12-24-8-10-25(11-9-24)13-6-4-3-5-7-13/h3-7H,2,8-12H2,1H3,(H2,19,21)
InChIKey	YBUGVXQMJFRLRU-UHFFFAOYSA-N Google Search
Mol Weight	398.43 g/mol
Molecular Formula	C18H22N8O3
Exact Mass	398.181487 g/mol

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SpectraBase Spectrum ID	8B55iI2UwiG
Name	1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(4-phenyl-1-piperazinyl)methyl]-4-triazolecarboxylic acid ethyl ester
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C18H22N8O3
InChI	InChI=1S/C18H22N8O3/c1-2-28-18(27)15-14(26(23-20-15)17-16(19)21-29-22-17)12-24-8-10-25(11-9-24)13-6-4-3-5-7-13/h3-7H,2,8-12H2,1H3,(H2,19,21)
InChIKey	YBUGVXQMJFRLRU-UHFFFAOYSA-N
Molecular Weight	398.427 g/mol
SMILES	Nc1c(-[n]2c(c(C(=O)OCC)nn2)CN2CCN(CC2)c2ccccc2)non1
SPLASH	splash10-0ae9-6900000000-f5d486be9dd8cac5d6eb
Synonyms	1-(4-aminofurazan-3-yl)-5-[(4-phenylpiperazino)methyl]triazole-4-carboxylic acid ethyl ester Ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(4-phenyl-1-piperazinyl)methyl]-1H-1,2,3-triazole-4-carboxylate Ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(4-phenylpiperazin-1-yl)methyl]triazole-4-carboxylate Ethyl 1-(4-azanyl-1,2,5-oxadiazol-3-yl)-5-[(4-phenylpiperazin-1-yl)methyl]-1,2,3-triazole-4-carboxylate
Wiley ID	1445013