Vitas-M small molecule compound
(5E)-5-(3,4-diethoxybenzylidene)-3-(1,1-dioxidotetrahydrothiophen-3-yl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK816771
SMILES CCOc1cc(ccc1OCC)/C=C\1/SC(=S)N(C1=O)C1CCS(=O)(=O)C1
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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 C18H21NO5S3 MW 427.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21NO5S3/c1-3-23-14-6-5-12(9-15(14)24-4-2)10-16-17(20)19(18(25)26-16)13-7-8-27(21,22)11-13/h5-6,9-10,13H,3-4,7-8,11H2,1-2H3/b16-10+InChIKey
KCMIBVRRVUWOAZ-MHWRWJLKSA-NSynonyms
(5E)5((34diethoxyphenyl)methylidene)3(11dioxothiolan3yl)2sulfanylidene13thiazolidin4one
(5E)5(34diethoxybenzylidene)3(11dioxidotetrahydrothiophen3yl)2thioxo13thiazolidin4one
(Z)5(34diethoxybenzylidene)3(11dioxidotetrahydrothiophen3yl)2thioxothiazolidin4one
CCOC1=C(C=C(C=C1)C=C2C(=O)N(C(=S)S2)C3CCS(=O)(=O)C3)OCC
CCOc1cc(ccc1OCC)C=C1SC(=S)N(C1=O)C1CCS(=O)(=O)C1
InChI=1SC18H21NO5S3c1323146512(915(14)2442)101617(20)19(18(25)2616)137827(2122)1113h5691013H347811H212H3b1610+
MFCD04446134
ZINC000026532032
ZINC000026532038
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