N-[(+)-1-methylbenzyl)-[4-benzyl-5-(3-pyridyl)-3H-1,2,4-triazole-3-ylthio]acetamide

SpectraBase Compound ID	6g4Swf1KoMF
InChI	InChI=1S/C24H23N5OS/c1-18(20-11-6-3-7-12-20)26-22(30)17-31-24-28-27-23(21-13-8-14-25-15-21)29(24)16-19-9-4-2-5-10-19/h2-15,18H,16-17H2,1H3,(H,26,30)
InChIKey	LSOQYJCUYVFIBT-UHFFFAOYSA-N Google Search
Mol Weight	429.54 g/mol
Molecular Formula	C24H23N5OS
Exact Mass	429.162332 g/mol

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SpectraBase Spectrum ID	AgCNT7IVjul
Name	N-[(+)-1-methylbenzyl)-[4-benzyl-5-(3-pyridyl)-3H-1,2,4-triazole-3-ylthio]acetamide
Comments	Computed using HOSE algorithm
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	429.162331554 u
Formula	C24H23N5OS
InChI	InChI=1S/C24H23N5OS/c1-18(20-11-6-3-7-12-20)26-22(30)17-31-24-28-27-23(21-13-8-14-25-15-21)29(24)16-19-9-4-2-5-10-19/h2-15,18H,16-17H2,1H3,(H,26,30)
InChIKey	LSOQYJCUYVFIBT-UHFFFAOYSA-N
Molecular Weight	429.542 g/mol
SMILES	C=1(N(C(=NN1)SCC(NC(C1=CC=CC=C1)C)=O)CC=1C=CC=CC1)C=1C=NC=CC1