Vitas-M small molecule compound

2-methoxy-4-[(Z)-(3-methyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]phenyl 3-methyl-1-benzofuran-2-carboxylate

Catalog ID
STK567323
SMILES COc1cc(ccc1OC(=O)c1oc2c(c1C)cccc2)/C=C/1\SC(=S)N(C1=O)C

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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 C22H17NO5S2 MW 439.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17NO5S2/c1-12-14-6-4-5-7-15(14)27-19(12)21(25)28-16-9-8-13(10-17(16)26-3)11-18-20(24)23(2)22(29)30-18/h4-11H,1-3H3/b18-11-
InChIKey
SMFXEFOHBVQCIH-WQRHYEAKSA-N
Synonyms
381710-88-9
(2METHOXY4((Z)(3METHYL4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)PHENYL)3METHYL1BENZOFURAN2CARBOXYLATE
(Z)2methoxy4((3methyl4oxo2thioxothiazolidin5ylidene)methyl)phenyl3methylbenzofuran2carboxylate
2METHOXY4((3METHYL4OXO2THIOXO(13THIAZOLIDIN5YLIDENE))METHYL)PHENYL3METHYLBENZO(D)FURAN2CARBOXYLATE
2methoxy4((Z)(3methyl4oxo2thioxo13thiazolidin5ylidene)methyl)phenyl3methyl1benzofuran2carboxylate
381710889
CC1=C(OC2=CC=CC=C12)C(=O)OC3=C(C=C(C=C3)C=C4C(=O)N(C(=S)S4)C)OC
COc1cc(ccc1OC(=O)c1oc2c(c1C)cccc2)C=C1SC(=S)N(C1=O)C
InChI=1SC22H17NO5S2c11214645715(14)2719(12)21(25)28169813(1017(16)263)111820(24)23(2)22(29)3018h411H13H3b1811
MFCD06595875
ZINC000002202406
ZINC02202406
ZINC2202406

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Available files

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