Vitas-M small molecule compound
2-[(5E)-5-{[5-(4-methoxyphenyl)furan-2-yl]methylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]pentanedioic acid
Catalog ID
STL036079
SMILES COc1ccc(cc1)c1ccc(o1)/C=C\1/SC(=S)N(C1=O)C(C(=O)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 C20H17NO7S2 MW 447.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17NO7S2/c1-27-12-4-2-11(3-5-12)15-8-6-13(28-15)10-16-18(24)21(20(29)30-16)14(19(25)26)7-9-17(22)23/h2-6,8,10,14H,7,9H2,1H3,(H,22,23)(H,25,26)/b16-10+InChIKey
HVZXQGGDSDUAQD-MHWRWJLKSA-NSynonyms
2((5E)5((5(4methoxyphenyl)furan2yl)methylidene)4oxo2sulfanylidene13thiazolidin3yl)pentanedioicacid
2((5E)5((5(4methoxyphenyl)furan2yl)methylidene)4oxo2thioxo13thiazolidin3yl)pentanedioicacid
COC1=CC=C(C=C1)C2=CC=C(O2)C=C3C(=O)N(C(=S)S3)C(CCC(=O)O)C(=O)O
COc1ccc(cc1)c1ccc(o1)C=C1SC(=S)N(C1=O)C(C(=O)O)CCC(=O)O
InChI=1SC20H17NO7S2c127124211(3512)158613(2815)101618(24)21(20(29)3016)14(19(25)26)7917(22)23h2681014H79H21H3(H2223)(H2526)b1610+
MFCD07997846
ZINC000016694895
ZINC000016694896
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