Vitas-M small molecule compound
4-({2-bromo-4-[(E)-{(2Z)-2-[(4-ethylphenyl)imino]-4-oxo-1,3-thiazolidin-5-ylidene}methyl]-6-methoxyphenoxy}methyl)benzoic acid
Catalog ID
STL558374
SMILES CCc1ccc(cc1)/N=C/1\S/C(=C/c2cc(Br)c(c(c2)OC)OCc2ccc(cc2)C(=O)O)/C(=O)N1
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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 C27H23BrN2O5S MW 567.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23BrN2O5S/c1-3-16-6-10-20(11-7-16)29-27-30-25(31)23(36-27)14-18-12-21(28)24(22(13-18)34-2)35-15-17-4-8-19(9-5-17)26(32)33/h4-14H,3,15H2,1-2H3,(H,32,33)(H,29,30,31)/b23-14+InChIKey
HHPXCPUDZZUQCL-OEAKJJBVSA-NSynonyms
135628678
4((2bromo4((~(E))(2(4ethylphenyl)imino4oxo13thiazolidin5ylidene)methyl)6methoxyphenoxy)methyl)benzoicacid
4((2bromo4((E)((2Z)2((4ethylphenyl)imino)4oxo13thiazolidin5ylidene)methyl)6methoxyphenoxy)methyl)benzoicacid
InChI=1SC27H23BrN2O5Sc131661020(11716)29273025(31)23(3627)14181221(28)24(22(1318)342)3515174819(9517)26(32)33h414H315H212H3(H3233)(H293031)b2314+
MFCD05041943
ZINC000104230254
ZINC104230254
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