Vitas-M small molecule compound
(5E)-3-[2-(3,4-dimethoxyphenyl)ethyl]-5-(4-hydroxy-3-methoxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK861806
SMILES COc1cc(CCN2C(=S)S/C(=C/c3ccc(c(c3)OC)O)/C2=O)ccc1OC
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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 C21H21NO5S2 MW 431.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21NO5S2/c1-25-16-7-5-13(10-18(16)27-3)8-9-22-20(24)19(29-21(22)28)12-14-4-6-15(23)17(11-14)26-2/h4-7,10-12,23H,8-9H2,1-3H3/b19-12+InChIKey
HAIPLSYQUCSYOS-XDHOZWIPSA-NSynonyms
(5E)3(2(34DIMETHOXYPHENYL)ETHYL)5((4HYDROXY3METHOXYPHENYL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(5E)3(2(34dimethoxyphenyl)ethyl)5(4hydroxy3methoxybenzylidene)2thioxo13thiazolidin4one
3(2(34DIMETHOXYPHENYL)ETHYL)5((4HYDROXY3METHOXYPHENYL)METHYLENE)2THIOXO13THIAZOLIDIN4ONE
COC1=C(C=C(C=C1)CCN2C(=O)C(=CC3=CC(=C(C=C3)O)OC)SC2=S)OC
COc1cc(CCN2C(=S)SC(=Cc3ccc(c(c3)OC)O)C2=O)ccc1OC
InChI=1SC21H21NO5S2c125167513(1018(16)273)892220(24)19(2921(22)28)12144615(23)17(1114)262h47101223H89H213H3b1912+
MFCD01458928
ZINC000001087692
ZINC000012371296
ZINC12371296
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