Vitas-M small molecule compound
[(5E)-5-(4-{[(2-iodophenyl)carbonyl]oxy}-3-methoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetic acid
Catalog ID
STL444673
SMILES COc1cc(ccc1OC(=O)c1ccccc1I)/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 C20H14INO6S2 MW 555.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H14INO6S2/c1-27-15-8-11(9-16-18(25)22(10-17(23)24)20(29)30-16)6-7-14(15)28-19(26)12-4-2-3-5-13(12)21/h2-9H,10H2,1H3,(H,23,24)/b16-9+InChIKey
RXTVVASYGQLVEI-CXUHLZMHSA-NSynonyms
((5E)5(4(((2iodophenyl)carbonyl)oxy)3methoxybenzylidene)4oxo2thioxo13thiazolidin3yl)aceticacid
2((5E)5((4(2IODOBENZOYL)OXY3METHOXYPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)ACETICACID
COC1=C(C=CC(=C1)C=C2C(=O)N(C(=S)S2)CC(=O)O)OC(=O)C3=CC=CC=C3I
COc1cc(ccc1OC(=O)c1ccccc1I)C=C1SC(=S)N(C1=O)CC(=O)O
InChI=1SC20H14INO6S2c12715811(91618(25)22(1017(23)24)20(29)3016)6714(15)2819(26)12423513(12)21h29H10H21H3(H2324)b169+
MFCD04084415
ZINC000100299783
ZINC100299783
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