Vitas-M small molecule compound
3-[(5Z)-5-{3-ethoxy-4-[2-oxo-2-(pyrrolidin-1-yl)ethoxy]benzylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]propanoic acid
Catalog ID
STK186206
SMILES CCOc1cc(ccc1OCC(=O)N1CCCC1)/C=C/1\SC(=S)N(C1=O)CCC(=O)O
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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 C21H24N2O6S2 MW 464.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N2O6S2/c1-2-28-16-11-14(5-6-15(16)29-13-18(24)22-8-3-4-9-22)12-17-20(27)23(21(30)31-17)10-7-19(25)26/h5-6,11-12H,2-4,7-10,13H2,1H3,(H,25,26)/b17-12-InChIKey
VWVRDGDAZDAVPU-ATVHPVEESA-NSynonyms
767323-18-23((5Z)5((3ethoxy4(2oxo2pyrrolidin1ylethoxy)phenyl)methylidene)4oxo2sulfanylidene13thiazolidin3yl)propanoicacid
3((5Z)5(3ETHOXY4(2OXO2(PYRROLIDIN1YL)ETHOXY)BENZYLIDENE)4OXO2THIOXO13THIAZOLIDIN3YL)PROPANOICACID
767323182
CCOC1=C(C=CC(=C1)C=C2C(=O)N(C(=S)S2)CCC(=O)O)OCC(=O)N3CCCC3
CCOc1cc(ccc1OCC(=O)N1CCCC1)C=C1SC(=S)N(C1=O)CCC(=O)O
InChI=1SC21H24N2O6S2c1228161114(5615(16)291318(24)22834922)121720(27)23(21(30)3117)10719(25)26h561112H2471013H21H3(H2526)b1712
MFCD08678415
ZINC000009907401
ZINC9907401
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