ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[(4-phenyl-5-thioxo-4,5-dihydro-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-1H-1,2,3-triazole-4-carboxylate

SpectraBase Compound ID	KajX2yUrc4c
InChI	InChI=1S/C16H14N8O3S3/c1-2-26-14(25)11-10(24(22-18-11)13-12(17)20-27-21-13)8-29-15-19-23(16(28)30-15)9-6-4-3-5-7-9/h3-7H,2,8H2,1H3,(H2,17,20)
InChIKey	HVDZSNQKBXTYGH-UHFFFAOYSA-N Google Search
Mol Weight	462.52 g/mol
Molecular Formula	C16H14N8O3S3
Exact Mass	462.0351 g/mol

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SpectraBase Spectrum ID	3QsRn1sHCRd
Name	1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[[(4-phenyl-5-sulfanylidene-1,3,4-thiadiazol-2-yl)thio]methyl]-4-triazolecarboxylic acid ethyl ester
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C16H14N8O3S3
InChI	InChI=1S/C16H14N8O3S3/c1-2-26-14(25)11-10(24(22-18-11)13-12(17)20-27-21-13)8-29-15-19-23(16(28)30-15)9-6-4-3-5-7-9/h3-7H,2,8H2,1H3,(H2,17,20)
InChIKey	HVDZSNQKBXTYGH-UHFFFAOYSA-N
Molecular Weight	462.521 g/mol
SMILES	Nc1c(-[n]2c(c(C(=O)OCC)nn2)CSC=2SC(=S)N(N2)c2ccccc2)non1
SPLASH	splash10-004r-9600000000-7fa684e45eab2c084eb8
Synonyms	1-(4-aminofurazan-3-yl)-5-[[(4-phenyl-5-thioxo-1,3,4-thiadiazol-2-yl)thio]methyl]triazole-4-carboxylic acid ethyl ester Ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(4-phenyl-5-sulfanylidene-1,3,4-thiadiazol-2-yl)sulfanylmethyl]triazole-4-carboxylate Ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(4-phenyl-5-thioxo-1,3,4-thiadiazol-2-yl)sulfanylmethyl]triazole-4-carboxylate Ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[(4-phenyl-5-thioxo-4,5-dihydro-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-1H-1,2,3-triazole-4-carboxylate Ethyl 1-(4-azanyl-1,2,5-oxadiazol-3-yl)-5-[(4-phenyl-5-sulfanylidene-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-1,2,3-triazole-4-carboxylate
Wiley ID	1465976