Vitas-M small molecule compound

dimethyl 5,5'-[(3-chlorophenyl)methanediyl]bis(4-hydroxy-2-methylthiophene-3-carboxylate)

Catalog ID
STK779452
SMILES COC(=O)c1c(C)sc(c1O)C(c1sc(c(c1O)C(=O)OC)C)c1cccc(c1)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 C21H19ClO6S2 MW 466.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19ClO6S2/c1-9-13(20(25)27-3)16(23)18(29-9)15(11-6-5-7-12(22)8-11)19-17(24)14(10(2)30-19)21(26)28-4/h5-8,15,23-24H,1-4H3
InChIKey
ZSKZSUYBHQRUJO-UHFFFAOYSA-N
Synonyms

CC1=C(C(=C(S1)C(C2=CC(=CC=C2)Cl)C3=C(C(=C(S3)C)C(=O)OC)O)O)C(=O)OC
dimethyl55((3chlorophenyl)methanediyl)bis(4hydroxy2methylthiophene3carboxylate)
InChI=1SC21H19ClO6S2c1913(20(25)273)16(23)18(299)15(1165712(22)811)1917(24)14(10(2)3019)21(26)284h58152324H14H3
METHYL5((3CHLOROPHENYL)(3HYDROXY4METHOXYCARBONYL5METHYLTHIOPHEN2YL)METHYL)4HYDROXY2METHYLTHIOPHENE3CARBOXYLATE
MFCD05858570
ZINC000012372139
ZINC12372139

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Available files

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