Vitas-M small molecule compound
ethyl (4-{(E)-[3-(3,4-dimethylphenyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-iodo-6-methoxyphenoxy)acetate
Catalog ID
STL419203
SMILES CCOC(=O)COc1c(I)cc(cc1OC)/C=C\1/SC(=S)N(C1=O)c1ccc(c(c1)C)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 C23H22INO5S2 MW 583.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22INO5S2/c1-5-29-20(26)12-30-21-17(24)9-15(10-18(21)28-4)11-19-22(27)25(23(31)32-19)16-7-6-13(2)14(3)8-16/h6-11H,5,12H2,1-4H3/b19-11+InChIKey
CJJFLMBGRGAGTA-YBFXNURJSA-NSynonyms
CCOC(=O)COC1=C(C=C(C=C1I)C=C2C(=O)N(C(=S)S2)C3=CC(=C(C=C3)C)C)OC
CCOC(=O)COc1c(I)cc(cc1OC)C=C1SC(=S)N(C1=O)c1ccc(c(c1)C)C
ethyl(4((E)(3(34dimethylphenyl)4oxo2thioxo13thiazolidin5ylidene)methyl)2iodo6methoxyphenoxy)acetate
ETHYL2(4((E)(3(34DIMETHYLPHENYL)4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)2IODO6METHOXYPHENOXY)ACETATE
InChI=1SC23H22INO5S2c152920(26)12302117(24)915(1018(21)284)111922(27)25(23(31)3219)167613(2)14(3)816h611H512H214H3b1911+
MFCD03614345
ZINC000100324491
ZINC100324491
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