1-(4-phenyl-5-thioxo-[1,2,4]triazol-3-yl)methyl-4-amino-3-propyl-5-oxo-4,5-dihydro-[1,2,4]triazole

SpectraBase Compound ID	3JOo1FHQy3r
InChI	InChI=1S/C14H17N7OS/c1-2-6-11-18-19(14(22)21(11)15)9-12-16-17-13(23)20(12)10-7-4-3-5-8-10/h3-5,7-8H,2,6,9,15H2,1H3,(H,17,23)
InChIKey	VHWNLZJQCPTQSW-UHFFFAOYSA-N Google Search
Mol Weight	331.4 g/mol
Molecular Formula	C14H17N7OS
Exact Mass	331.121529 g/mol

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SpectraBase Spectrum ID	KSqHQib0ER
Name	1-(4-phenyl-5-thioxo-[1,2,4]triazol-3-yl)methyl-4-amino-3-propyl-5-oxo-4,5-dihydro-[1,2,4]triazole
Alternate Name(s)	1-[(4-phenyl-5-thioxo-[1,2,4]triazol-3-yl)methyl]-4-amino-3-propyl-5-oxo-4,5-dihydro-[1,2,4]triazole 4-Amino-1-((4-phenyl-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-3-yl)methyl)-3-propyl-1H-1,2,4-triazol-5(4H)-one 4-Amino-2-[(4-phenyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methyl]-5-propyl-1,2,4-triazol-3-one 4-Azanyl-2-[(4-phenyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methyl]-5-propyl-1,2,4-triazol-3-one
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C14H17N7OS
InChI	InChI=1S/C14H17N7OS/c1-2-6-11-18-19(14(22)21(11)15)9-12-16-17-13(23)20(12)10-7-4-3-5-8-10/h3-5,7-8H,2,6,9,15H2,1H3,(H,17,23)
InChIKey	VHWNLZJQCPTQSW-UHFFFAOYSA-N
Molecular Weight	331.398 g/mol
SMILES	N1C(N(C(CN2C(N(C(=N2)CCC)N)=O)=N1)c1ccccc1)=S
SPLASH	splash10-0059-9134000000-67170c581873252d6b73
Source of Spectrum	EMC-39-802-8c
Wiley ID	1734913