Vitas-M small molecule compound

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

Catalog ID
STK783724
SMILES CCOC(=O)c1c(C)sc(c1O)C(c1sc(c(c1O)C(=O)OCC)C)c1ccccc1Cl

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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 C23H23ClO6S2 MW 495.02 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23ClO6S2/c1-5-29-22(27)15-11(3)31-20(18(15)25)17(13-9-7-8-10-14(13)24)21-19(26)16(12(4)32-21)23(28)30-6-2/h7-10,17,25-26H,5-6H2,1-4H3
InChIKey
PIHJGGYOUSOOEX-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(SC(=C1O)C(C2=CC=CC=C2Cl)C3=C(C(=C(S3)C)C(=O)OCC)O)C
diethyl55((2chlorophenyl)methanediyl)bis(4hydroxy2methylthiophene3carboxylate)
ETHYL5((2CHLOROPHENYL)(4ETHOXYCARBONYL3HYDROXY5METHYLTHIOPHEN2YL)METHYL)4HYDROXY2METHYLTHIOPHENE3CARBOXYLATE
InChI=1SC23H23ClO6S2c152922(27)1511(3)3120(18(15)25)17(139781014(13)24)2119(26)16(12(4)3221)23(28)3062h710172526H56H214H3
MFCD06618872
ZINC000012413791
ZINC12413791

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Available files

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