Vitas-M small molecule compound
dimethyl 5,5'-[2-(5-chlorothiophen-2-yl)-2-oxoethane-1,1-diyl]bis(4-hydroxy-2-methylthiophene-3-carboxylate)
Catalog ID
STK786166
SMILES COC(=O)c1c(C)sc(c1O)C(c1sc(c(c1O)C(=O)OC)C)C(=O)c1ccc(s1)Cl
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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 C20H17ClO7S3 MW 501.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17ClO7S3/c1-7-11(19(25)27-3)15(23)17(29-7)13(14(22)9-5-6-10(21)31-9)18-16(24)12(8(2)30-18)20(26)28-4/h5-6,13,23-24H,1-4H3InChIKey
DWRSXTFRUXLFMH-UHFFFAOYSA-NSynonyms
CC1=C(C(=C(S1)C(C2=C(C(=C(S2)C)C(=O)OC)O)C(=O)C3=CC=C(S3)Cl)O)C(=O)OC
dimethyl55(2(5chlorothiophen2yl)2oxoethane11diyl)bis(4hydroxy2methylthiophene3carboxylate)
InChI=1SC20H17ClO7S3c1711(19(25)273)15(23)17(297)13(14(22)95610(21)319)1816(24)12(8(2)3018)20(26)284h56132324H14H3
methyl5(2(5chlorothiophen2yl)1(3hydroxy4methoxycarbonyl5methylthiophen2yl)2oxoethyl)4hydroxy2methylthiophene3carboxylate
MFCD08142841
ZINC000012372122
ZINC12372122
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