Vitas-M small molecule compound

N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-(4-fluorobenzyl)-2-(6-methyl-1-benzofuran-3-yl)acetamide

Catalog ID
STK911053
SMILES Fc1ccc(cc1)CN(C1CCS(=O)(=O)C1)C(=O)Cc1coc2c1ccc(c2)C

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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 C22H22FNO4S MW 415.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22FNO4S/c1-15-2-7-20-17(13-28-21(20)10-15)11-22(25)24(19-8-9-29(26,27)14-19)12-16-3-5-18(23)6-4-16/h2-7,10,13,19H,8-9,11-12,14H2,1H3
InChIKey
FJOAPMBLBIBMNP-UHFFFAOYSA-N
Synonyms
872867-59-9
872867599
CC1=CC2=C(C=C1)C(=CO2)CC(=O)N(CC3=CC=C(C=C3)F)C4CCS(=O)(=O)C4
InChI=1SC22H22FNO4Sc115272017(132821(20)1015)1122(25)24(198929(2627)1419)12163518(23)6416h27101319H89111214H21H3
MFCD07425946
N(11dioxidotetrahydrothiophen3yl)N(4fluorobenzyl)2(6methyl1benzofuran3yl)acetamide
N(11dioxothiolan3yl)N((4fluorophenyl)methyl)2(6methyl1benzofuran3yl)acetamide
ZINC000006809937
ZINC000006809938

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Available files

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