Vitas-M small molecule compound
dimethyl (4R,5R)-2-(2-oxo-2-phenylethylidene)-1,3-dithiolane-4,5-dicarboxylate
Catalog ID
STK331812
SMILES COC(=O)[C@H]1S/C(=C/C(=O)c2ccccc2)/S[C@@H]1C(=O)OC
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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 C15H14O5S2 MW 338.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H14O5S2/c1-19-14(17)12-13(15(18)20-2)22-11(21-12)8-10(16)9-6-4-3-5-7-9/h3-8,12-13H,1-2H3/t12-,13-/m0/s1InChIKey
XCNVXOOWOSSUAS-STQMWFEESA-NSynonyms
COC(=O)(C@H)1SC(=CC(=O)c2ccccc2)S(C@@H)1C(=O)OC
COC(=O)C1C(SC(=CC(=O)C2=CC=CC=C2)S1)C(=O)OC
dimethyl(4R5R)2(2oxo2phenylethylidene)13dithiolane45dicarboxylate
dimethyl(4R5R)2phenacylidene13dithiolane45dicarboxylate
InChI=1SC15H14O5S2c11914(17)1213(15(18)202)2211(2112)810(16)9643579h381213H12H3t1213m0s1
MFCD09962605
ZINC000018194639
ZINC18194639
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