3,5-bis[(4-nitrobenzyl)sulfanyl]-1-phenyl-1H-1,2,4-triazole

SpectraBase Compound ID	7bSTHYO4ZZs
InChI	InChI=1S/C22H17N5O4S2/c28-26(29)19-10-6-16(7-11-19)14-32-21-23-22(25(24-21)18-4-2-1-3-5-18)33-15-17-8-12-20(13-9-17)27(30)31/h1-13H,14-15H2
InChIKey	OSEWPXHTZQIZPO-UHFFFAOYSA-N Google Search
Mol Weight	479.53 g/mol
Molecular Formula	C22H17N5O4S2
Exact Mass	479.072196 g/mol

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SpectraBase Spectrum ID	z43tsZmtzm
Name	3,5-bis[(4-nitrobenzyl)thio]-1-phenyl-1,2,4-triazole
Alternate Name(s)	3,5-bis[(4-nitrophenyl)methylsulfanyl]-1-phenyl-1,2,4-triazole 3,5-bis[(4-nitrophenyl)methylthio]-1-phenyl-1,2,4-triazole
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C22H17N5O4S2
InChI	InChI=1S/C22H17N5O4S2/c28-26(29)19-10-6-16(7-11-19)14-32-21-23-22(25(24-21)18-4-2-1-3-5-18)33-15-17-8-12-20(13-9-17)27(30)31/h1-13H,14-15H2
InChIKey	OSEWPXHTZQIZPO-UHFFFAOYSA-N
Molecular Weight	479.529 g/mol
SMILES	c1ccc(-[n]2c(nc(n2)SCc2ccc(N(=O)=O)cc2)SCc2ccc(N(=O)=O)cc2)cc1
SPLASH	splash10-004i-9612200000-28af434968b49d23046a
Wiley ID	1462197