acetic acid, [[1-[(4-methylphenyl)methyl]-1H-benzimidazol-2-yl]thio]-, 2-[(E)-(4-bromophenyl)methylidene]hydrazide

SpectraBase Compound ID	DR8grxhta4t
InChI	InChI=1S/C24H21BrN4OS/c1-17-6-8-19(9-7-17)15-29-22-5-3-2-4-21(22)27-24(29)31-16-23(30)28-26-14-18-10-12-20(25)13-11-18/h2-14H,15-16H2,1H3,(H,28,30)/b26-14+
InChIKey	PYESSTXGJDQTTJ-VULFUBBASA-N Google Search
Mol Weight	493.42 g/mol
Molecular Formula	C24H21BrN4OS
Exact Mass	492.061945 g/mol

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SpectraBase Spectrum ID	B7aDy1yTfBQ
Name	Acetic acid, [[1-[(4-methylphenyl)methyl]-1H-benzimidazol-2-yl]thio]-, 2-[(E)-(4-bromophenyl)methylidene]hydrazide
Comments	Computed using HOSE algorithm
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	492.061945485 u
Formula	C24H21BrN4OS
InChI	InChI=1S/C24H21BrN4OS/c1-17-6-8-19(9-7-17)15-29-22-5-3-2-4-21(22)27-24(29)31-16-23(30)28-26-14-18-10-12-20(25)13-11-18/h2-14H,15-16H2,1H3,(H,28,30)/b26-14+
InChIKey	PYESSTXGJDQTTJ-VULFUBBASA-N
Molecular Weight	493.423 g/mol
SMILES	N(\N=C\C1=CC=C(C=C1)Br)C(CSC=1N(C=2C=CC=CC2N1)CC=1C=CC(=CC1)C)=O