Vitas-M small molecule compound
methyl 4-{3-[4-(1,1-dioxidotetrahydrothiophen-3-yl)piperazin-1-yl]-2-hydroxypropoxy}benzoate
Catalog ID
STL153711
SMILES COC(=O)c1ccc(cc1)OCC(CN1CCN(CC1)C1CCS(=O)(=O)C1)O
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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 C19H28N2O6S MW 412.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H28N2O6S/c1-26-19(23)15-2-4-18(5-3-15)27-13-17(22)12-20-7-9-21(10-8-20)16-6-11-28(24,25)14-16/h2-5,16-17,22H,6-14H2,1H3InChIKey
GSWRSJFNYUOQEJ-UHFFFAOYSA-NSynonyms
1324080-63-81324080638
COC(=O)C1=CC=C(C=C1)OCC(CN2CCN(CC2)C3CCS(=O)(=O)C3)O
InChI=1SC19H28N2O6Sc12619(23)152418(5315)271317(22)12207921(10820)1661128(2425)1416h25161722H614H21H3
methyl4(3(4(11dioxidotetrahydrothiophen3yl)piperazin1yl)2hydroxypropoxy)benzoate
methyl4(3(4(11dioxothiolan3yl)piperazin1yl)2hydroxypropoxy)benzoate
MFCD19708177
ZINC000032772647
ZINC000032772656
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