benzamide, 4-nitro-N-octyl-2-[(phenylmethyl)thio]-

SpectraBase Compound ID	A5xj7xyFiPc
InChI	InChI=1S/C22H28N2O3S/c1-2-3-4-5-6-10-15-23-22(25)20-14-13-19(24(26)27)16-21(20)28-17-18-11-8-7-9-12-18/h7-9,11-14,16H,2-6,10,15,17H2,1H3,(H,23,25)
InChIKey	SIBUBLABMJANOI-UHFFFAOYSA-N Google Search
Mol Weight	400.54 g/mol
Molecular Formula	C22H28N2O3S
Exact Mass	400.182064 g/mol

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SpectraBase Spectrum ID	B8ri8p9Bz4t
Name	2-Benzylsulfanyl-4-nitro-n-octyl-benzamide
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C22H28N2O3S
InChI	InChI=1S/C22H28N2O3S/c1-2-3-4-5-6-10-15-23-22(25)20-14-13-19(24(26)27)16-21(20)28-17-18-11-8-7-9-12-18/h7-9,11-14,16H,2-6,10,15,17H2,1H3,(H,23,25)
InChIKey	SIBUBLABMJANOI-UHFFFAOYSA-N
Molecular Weight	400.537 g/mol
SMILES	N(C(c1c(cc(N(=O)=O)cc1)SCc1ccccc1)=O)CCCCCCCC
SPLASH	splash10-0006-9101000000-ad369f71c3212afce2e0
Synonyms	2-(benzylthio)-4-nitro-N-octyl-benzamide 4-Nitro-N-octyl-2-(phenylmethylsulfanyl)benzamide 4-Nitro-N-octyl-2-(phenylmethylthio)benzamide
Wiley ID	1459661