1-[5-(N-Phenyl-N-mercaptoethyl)amino-3-(p-methylphenyl)-1H-pyrazol-4-yl]-1,2,4-triazole

SpectraBase Compound ID	E7O6NEPQ0Xx
InChI	InChI=1S/C20H20N6S/c1-15-7-9-16(10-8-15)18-19(26-14-21-13-22-26)20(24-23-18)25(11-12-27)17-5-3-2-4-6-17/h2-10,13-14,27H,11-12H2,1H3,(H,23,24)
InChIKey	RDOFKXVQWQECSM-UHFFFAOYSA-N Google Search
Mol Weight	376.48 g/mol
Molecular Formula	C20H20N6S
Exact Mass	376.147016 g/mol

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SpectraBase Spectrum ID	5gENfSo9R3I
Name	1-[5-(N-Phenyl-N-mercaptoethyl)amino-3-(p-methylphenyl)-1H-pyrazol-4-yl]-1,2,4-triazole
Alternate Name(s)	2-{[3-(4-methylphenyl)-4-(1H-1,2,4-triazol-1-yl)-1H-pyrazol-5-yl]anilino}ethanethiol 2-{[3-(4-methylphenyl)-4-(1H-1,2,4-triazol-1-yl)-1H-pyrazol-5-yl]anilino}ethyl hydrosulfide 2-(N-[5-(4-methylphenyl)-4-(1,2,4-triazol-1-yl)-1H-pyrazol-3-yl]anilino)ethanethiol 2-[[5-(4-methylphenyl)-4-(1,2,4-triazol-1-yl)-1H-pyrazol-3-yl]-phenyl-amino]ethanethiol
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C20H20N6S
InChI	InChI=1S/C20H20N6S/c1-15-7-9-16(10-8-15)18-19(26-14-21-13-22-26)20(24-23-18)25(11-12-27)17-5-3-2-4-6-17/h2-10,13-14,27H,11-12H2,1H3,(H,23,24)
InChIKey	RDOFKXVQWQECSM-UHFFFAOYSA-N
Molecular Weight	376.482 g/mol
SMILES	[nH]1nc(c(c1N(CCS)c1ccccc1)-[n]1ncnc1)-c1ccc(cc1)C
SPLASH	splash10-004i-9106000000-5e8d32e602d49697866d
Source of Spectrum	H1-41-1656-3
Wiley ID	757323