Vitas-M small molecule compound

ethyl 4-({4-[(1,1-dioxidotetrahydrothiophen-3-yl)sulfonyl]phenyl}carbonyl)piperazine-1-carboxylate

Catalog ID
STK649779
SMILES CCOC(=O)N1CCN(CC1)C(=O)c1ccc(cc1)S(=O)(=O)C1CCS(=O)(=O)C1

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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 C18H24N2O7S2 MW 444.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H24N2O7S2/c1-2-27-18(22)20-10-8-19(9-11-20)17(21)14-3-5-15(6-4-14)29(25,26)16-7-12-28(23,24)13-16/h3-6,16H,2,7-13H2,1H3
InChIKey
IWNOHXDSOQDDGS-UHFFFAOYSA-N
Synonyms
1011871-79-6
1011871796
CCOC(=O)N1CCN(CC1)C(=O)C2=CC=C(C=C2)S(=O)(=O)C3CCS(=O)(=O)C3
ethyl4((4((11dioxidotetrahydrothiophen3yl)sulfonyl)phenyl)carbonyl)piperazine1carboxylate
ethyl4(4((11dioxidotetrahydrothiophen3yl)sulfonyl)benzoyl)piperazine1carboxylate
ethyl4(4(11dioxothiolan3yl)sulfonylbenzoyl)piperazine1carboxylate
InChI=1SC18H24N2O7S2c122718(22)2010819(91120)17(21)143515(6414)29(2526)1671228(2324)1316h3616H2713H21H3
MFCD10077726
ZINC000012029564
ZINC000012029567

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Available files

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