Vitas-M small molecule compound

4-[4-(2,3-dimethylphenyl)piperazin-1-yl]tetrahydrothiophene-3-ol 1,1-dioxide

Catalog ID
STL351132
SMILES OC1CS(=O)(=O)CC1N1CCN(CC1)c1cccc(c1C)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 C16H24N2O3S MW 324.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H24N2O3S/c1-12-4-3-5-14(13(12)2)17-6-8-18(9-7-17)15-10-22(20,21)11-16(15)19/h3-5,15-16,19H,6-11H2,1-2H3
InChIKey
PQLDSTHIIRVRQT-UHFFFAOYSA-N
Synonyms
951938-31-1
3(4(23dimethylphenyl)piperazin1yl)4hydroxytetrahydrothiophene11dioxide
4(4(23dimethylphenyl)piperazin1yl)11dioxothiolan3ol
4(4(23dimethylphenyl)piperazin1yl)tetrahydrothiophene3ol11dioxide
951938311
CC1=C(C(=CC=C1)N2CCN(CC2)C3CS(=O)(=O)CC3O)C
InChI=1SC16H24N2O3Sc11243514(13(12)2)176818(9717)151022(2021)1116(15)19h35151619H611H212H3
MFCD09856647
ZINC000013727245
ZINC000013727253

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Available files

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