Vitas-M small molecule compound

3-butoxy-N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-[(3-methylthiophen-2-yl)methyl]benzamide

Catalog ID
STK882348
SMILES CCCCOc1cccc(c1)C(=O)N(C1CCS(=O)(=O)C1)Cc1sccc1C

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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 C21H27NO4S2 MW 421.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27NO4S2/c1-3-4-10-26-19-7-5-6-17(13-19)21(23)22(14-20-16(2)8-11-27-20)18-9-12-28(24,25)15-18/h5-8,11,13,18H,3-4,9-10,12,14-15H2,1-2H3
InChIKey
ZFNZOUSEMLQBHW-UHFFFAOYSA-N
Synonyms
879949-95-8
3butoxyN(11dioxidotetrahydrothiophen3yl)N((3methylthiophen2yl)methyl)benzamide
3butoxyN(11dioxothiolan3yl)N((3methylthiophen2yl)methyl)benzamide
879949958
CCCCOC1=CC=CC(=C1)C(=O)N(CC2=C(C=CS2)C)C3CCS(=O)(=O)C3
InChI=1SC21H27NO4S2c13410261975617(1319)21(23)22(142016(2)8112720)1891228(2425)1518h58111318H34910121415H212H3
MFCD06646138
ZINC000006810248
ZINC000006810249

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Available files

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