3-(Benzenesulfonyl)-2-[3-(benzyloxy)propyl]-1H-pyrrolo-[2,3-b]pyridine

SpectraBase Compound ID	JY0vPBjf1hO
InChI	InChI=1S/C23H22N2O3S/c26-29(27,19-11-5-2-6-12-19)22-20-13-7-15-24-23(20)25-21(22)14-8-16-28-17-18-9-3-1-4-10-18/h1-7,9-13,15H,8,14,16-17H2,(H,24,25)
InChIKey	MXWGJTKZVZSLFX-UHFFFAOYSA-N Google Search
Mol Weight	406.5 g/mol
Molecular Formula	C23H22N2O3S
Exact Mass	406.135114 g/mol

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SpectraBase Spectrum ID	JRDfJaWf83O
Name	3-(Benzenesulfonyl)-2-[3-(benzyloxy)propyl]-1H-pyrrolo-[2,3-b]pyridine
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C23H22N2O3S
InChI	InChI=1S/C23H22N2O3S/c26-29(27,19-11-5-2-6-12-19)22-20-13-7-15-24-23(20)25-21(22)14-8-16-28-17-18-9-3-1-4-10-18/h1-7,9-13,15H,8,14,16-17H2,(H,24,25)
InChIKey	MXWGJTKZVZSLFX-UHFFFAOYSA-N
Literature Reference DOI	10.1021/jo502150v
Molecular Weight	406.500 g/mol
SMILES	[nH]1c2c(c(c1CCCOCc1ccccc1)S(=O)(c1ccccc1)=O)cccn2
SPLASH	splash10-05mo-7690000000-7d4e3da1687a5f42e1dc
Source of Spectrum	J-79-11273-16b
Synonyms	2-(3-(benzyloxy)propyl)-3-(phenylsulfonyl)-1H-pyrrolo[2,3-b]pyridine
Wiley ID	1755711