Vitas-M small molecule compound
{(5E)-5-[4-(benzyloxy)-3-methoxybenzylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}acetic acid
Catalog ID
STK047921
SMILES COc1cc(ccc1OCc1ccccc1)/C=C\1/SC(=S)N(C1=O)CC(=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 C20H17NO5S2 MW 415.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17NO5S2/c1-25-16-9-14(7-8-15(16)26-12-13-5-3-2-4-6-13)10-17-19(24)21(11-18(22)23)20(27)28-17/h2-10H,11-12H2,1H3,(H,22,23)/b17-10+InChIKey
PXTOHAYEDIHZAY-LICLKQGHSA-NSynonyms
((5E)5(4(BENZYLOXY)3METHOXYBENZYLIDENE)4OXO2THIOXO13THIAZOLIDIN3YL)ACETICACID
2((5E)5((3methoxy4phenylmethoxyphenyl)methylidene)4oxo2sulfanylidene13thiazolidin3yl)aceticacid
2((5E)5((4BENZYLOXY3METHOXYPHENYL)METHYLENE)4OXO2THIOXOTHIAZOLIDIN3YL)ACETICACID
COC1=C(C=CC(=C1)C=C2C(=O)N(C(=S)S2)CC(=O)O)OCC3=CC=CC=C3
COc1cc(ccc1OCc1ccccc1)C=C1SC(=S)N(C1=O)CC(=O)O
InChI=1SC20H17NO5S2c12516914(7815(16)2612135324613)101719(24)21(1118(22)23)20(27)2817h210H1112H21H3(H2223)b1710+
MFCD00763657
STK047921
ZINC000000967105
ZINC967105
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