Vitas-M small molecule compound
{(5E)-5-[4-(carboxymethoxy)-3-ethoxybenzylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}acetic acid
Catalog ID
STK005538
SMILES CCOc1cc(ccc1OCC(=O)O)/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 C16H15NO7S2 MW 397.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15NO7S2/c1-2-23-11-5-9(3-4-10(11)24-8-14(20)21)6-12-15(22)17(7-13(18)19)16(25)26-12/h3-6H,2,7-8H2,1H3,(H,18,19)(H,20,21)/b12-6+InChIKey
YNCBIKOEOBCJQK-WUXMJOGZSA-NSynonyms
((5E)5(4(CARBOXYMETHOXY)3ETHOXYBENZYLIDENE)4OXO2THIOXO13THIAZOLIDIN3YL)ACETICACID
2((5E)5((4(carboxymethoxy)3ethoxyphenyl)methylidene)4oxo2sulfanylidene13thiazolidin3yl)aceticacid
2((5E)5((4(CARBOXYMETHYLOXY)3ETHOXYPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)ACETICACID
CCOC1=C(C=CC(=C1)C=C2C(=O)N(C(=S)S2)CC(=O)O)OCC(=O)O
CCOc1cc(ccc1OCC(=O)O)C=C1SC(=S)N(C1=O)CC(=O)O
InChI=1SC16H15NO7S2c12231159(3410(11)24814(20)21)61215(22)17(713(18)19)16(25)2612h36H278H21H3(H1819)(H2021)b126+
MFCD01963650
STK005538
ZINC000002121672
ZINC2121672
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