Vitas-M small molecule compound

3-butoxy-N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-(2-fluorobenzyl)benzamide

Catalog ID
STK882902
SMILES CCCCOc1cccc(c1)C(=O)N(C1CCS(=O)(=O)C1)Cc1ccccc1F

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C22H26FNO4S MW 419.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26FNO4S/c1-2-3-12-28-20-9-6-8-17(14-20)22(25)24(19-11-13-29(26,27)16-19)15-18-7-4-5-10-21(18)23/h4-10,14,19H,2-3,11-13,15-16H2,1H3
InChIKey
BWQHIAUUGMYIDW-UHFFFAOYSA-N
Synonyms

3butoxyN(11dioxidotetrahydrothiophen3yl)N(2fluorobenzyl)benzamide
3butoxyN(11dioxothiolan3yl)N((2fluorophenyl)methyl)benzamide
CCCCOC1=CC=CC(=C1)C(=O)N(CC2=CC=CC=C2F)C3CCS(=O)(=O)C3
InChI=1SC22H26FNO4Sc12312282096817(1420)22(25)24(19111329(2627)1619)15187451021(18)23h4101419H2311131516H21H3
MFCD06646518
ZINC000016750011
ZINC000016750014

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.