Vitas-M small molecule compound

2-[(5Z)-5-(3-ethoxy-4-hydroxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-3-methylbutanoic acid

Catalog ID
STK544145
SMILES CCOc1cc(ccc1O)/C=C/1\SC(=S)N(C1=O)C(C(=O)O)C(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 C17H19NO5S2 MW 381.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19NO5S2/c1-4-23-12-7-10(5-6-11(12)19)8-13-15(20)18(17(24)25-13)14(9(2)3)16(21)22/h5-9,14,19H,4H2,1-3H3,(H,21,22)/b13-8-
InChIKey
IWXBLKQFHOBYGK-JYRVWZFOSA-N
Synonyms
299952-52-6
(Z)2(5(3ethoxy4hydroxybenzylidene)4oxo2thioxothiazolidin3yl)3methylbutanoicacid
2((5Z)5((3ETHOXY4HYDROXYPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)3METHYLBUTANOICACID
2((5Z)5(3ethoxy4hydroxybenzylidene)4oxo2thioxo13thiazolidin3yl)3methylbutanoicacid
2(5((3ETHOXY4HYDROXYPHENYL)METHYLENE)4OXO2THIOXO(13THIAZOLIDIN3YL))3METHYLBUTANOICACID
299952526
CCOC1=C(C=CC(=C1)C=C2C(=O)N(C(=S)S2)C(C(C)C)C(=O)O)O
CCOc1cc(ccc1O)C=C1SC(=S)N(C1=O)C(C(=O)O)C(C)C
InChI=1SC17H19NO5S2c142312710(5611(12)19)81315(20)18(17(24)2513)14(9(2)3)16(21)22h591419H4H213H3(H2122)b138
MFCD00710961
ZINC000013576651
ZINC000013576653

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Available files

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