Vitas-M small molecule compound

N-[(5-bromofuran-2-yl)methyl]-N-(1,1-dioxidotetrahydrothiophen-3-yl)-4-ethoxybenzamide

Catalog ID
STK518211
SMILES CCOc1ccc(cc1)C(=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/c1-2-24-15-5-3-13(4-6-15)18(21)20(11-16-7-8-17(19)25-16)14-9-10-26(22,23)12-14/h3-8,14H,2,9-12H2,1H3
InChIKey
RXLXKSZXROMOGU-UHFFFAOYSA-N
Synonyms
898606-73-0
898606730
CCOC1=CC=C(C=C1)C(=O)N(CC2=CC=C(O2)Br)C3CCS(=O)(=O)C3
InChI=1SC18H20BrNO5Sc1224155313(4615)18(21)20(11167817(19)2516)1491026(2223)1214h3814H2912H21H3
MFCD08549529
N((5bromofuran2yl)methyl)N(11dioxidotetrahydrothiophen3yl)4ethoxybenzamide
N((5bromofuran2yl)methyl)N(11dioxothiolan3yl)4ethoxybenzamide
ZINC000011913999
ZINC000011914000

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Available files

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