Vitas-M small molecule compound

N-[(5-bromofuran-2-yl)methyl]-N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-(3-methylphenoxy)acetamide

Catalog ID
STK518247
SMILES Cc1cccc(c1)OCC(=O)N(C1CCS(=O)(=O)C1)Cc1ccc(o1)Br

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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 C18H20BrNO5S MW 442.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20BrNO5S/c1-13-3-2-4-15(9-13)24-11-18(21)20(10-16-5-6-17(19)25-16)14-7-8-26(22,23)12-14/h2-6,9,14H,7-8,10-12H2,1H3
InChIKey
PKTGMFPTJYAECH-UHFFFAOYSA-N
Synonyms
898622-91-8
898622918
CC1=CC(=CC=C1)OCC(=O)N(CC2=CC=C(O2)Br)C3CCS(=O)(=O)C3
InChI=1SC18H20BrNO5Sc11332415(913)241118(21)20(10165617(19)2516)147826(2223)1214h26914H781012H21H3
MFCD08549542
N((5bromofuran2yl)methyl)N(11dioxidotetrahydrothiophen3yl)2(3methylphenoxy)acetamide
N((5bromofuran2yl)methyl)N(11dioxothiolan3yl)2(3methylphenoxy)acetamide
ZINC000011914027
ZINC000011914028

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Available files

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