Vitas-M small molecule compound

N-benzyl-N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-(4-ethylphenoxy)propanamide

Catalog ID
STK818439
SMILES CCc1ccc(cc1)OC(C(=O)N(C1CCS(=O)(=O)C1)Cc1ccccc1)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 C22H27NO4S MW 401.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27NO4S/c1-3-18-9-11-21(12-10-18)27-17(2)22(24)23(15-19-7-5-4-6-8-19)20-13-14-28(25,26)16-20/h4-12,17,20H,3,13-16H2,1-2H3
InChIKey
QZTVWMAACNNMCT-UHFFFAOYSA-N
Synonyms
620555-37-5
620555375
CCC1=CC=C(C=C1)OC(C)C(=O)N(CC2=CC=CC=C2)C3CCS(=O)(=O)C3
InChI=1SC22H27NO4Sc131891121(121018)2717(2)22(24)23(15197546819)20131428(2526)1620h4121720H31316H212H3
MFCD04447885
NbenzylN(11dioxidotetrahydrothiophen3yl)2(4ethylphenoxy)propanamide
NBENZYLN(11DIOXOTHIOLAN3YL)2(4ETHYLPHENOXY)PROPANAMIDE
ZINC000004182880
ZINC000004182894

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Available files

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