Vitas-M small molecule compound
5-{2-[4-(1,1-dioxidotetrahydrothiophen-3-yl)piperazin-1-yl]-2-oxoethoxy}-2-methyl-4H-pyran-4-one
Catalog ID
STL246225
SMILES O=C(N1CCN(CC1)C1CCS(=O)(=O)C1)COc1coc(cc1=O)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 C16H22N2O6S MW 370.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H22N2O6S/c1-12-8-14(19)15(9-23-12)24-10-16(20)18-5-3-17(4-6-18)13-2-7-25(21,22)11-13/h8-9,13H,2-7,10-11H2,1H3InChIKey
LXWBEULNWPFFNL-UHFFFAOYSA-NSynonyms
1374532-97-41374532974
5(2(4(11dioxidotetrahydrothiophen3yl)piperazin1yl)2oxoethoxy)2methyl4Hpyran4one
5(2(4(11dioxothiolan3yl)piperazin1yl)2oxoethoxy)2methylpyran4one
CC1=CC(=O)C(=CO1)OCC(=O)N2CCN(CC2)C3CCS(=O)(=O)C3
InChI=1SC16H22N2O6Sc112814(19)15(92312)241016(20)185317(4618)132725(2122)1113h8913H271011H21H3
MFCD22202705
ZINC000072404066
ZINC000072404067
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