2-[(thioxanthen-9-yl)methyl]benzimidazole, S-oxide

SpectraBase Compound ID	4E2f4L3isyX
InChI	InChI=1S/C21H16N2OS/c24-25-19-11-5-1-7-14(19)16(15-8-2-6-12-20(15)25)13-21-22-17-9-3-4-10-18(17)23-21/h1-12,16H,13H2,(H,22,23)
InChIKey	DEMBIUBPFBQCFE-UHFFFAOYSA-N Google Search
Mol Weight	344.43 g/mol
Molecular Formula	C21H16N2OS
Exact Mass	344.098334 g/mol

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SpectraBase Spectrum ID	B0S75Bk3tfE
Name	9-(1H-Benzimidazol-2-ylmethyl)-9H-thioxanthene-10-oxide
Alternate Name(s)	2-[(5-oxido-10H-dibenzo[b,e]thiopyran-10-yl)methyl]-1H-benzimidazole
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C21H16N2OS
InChI	InChI=1S/C21H16N2OS/c24-25-19-11-5-1-7-14(19)16(15-8-2-6-12-20(15)25)13-21-22-17-9-3-4-10-18(17)23-21/h1-12,16H,13H2,(H,22,23)
InChIKey	DEMBIUBPFBQCFE-UHFFFAOYSA-N
Molecular Weight	344.432 g/mol
SMILES	[nH]1c2ccccc2nc1CC1c2c(S(c3c1cccc3)=O)cccc2
SPLASH	splash10-0002-0901000000-e79646e5639b023c5a5f
Source of Spectrum	E1-37-1077-3
Wiley ID	1517631