Vitas-M small molecule compound
methyl 4-{[(2E,5E)-3-methyl-5-(2-{2-[(4-methylphenyl)amino]-2-oxoethoxy}benzylidene)-4-oxo-1,3-thiazolidin-2-ylidene]amino}benzoate
Catalog ID
STK113317
SMILES COC(=O)c1ccc(cc1)/N=C\1/S/C(=C/c2ccccc2OCC(=O)Nc2ccc(cc2)C)/C(=O)N1C
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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 C28H25N3O5S MW 515.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25N3O5S/c1-18-8-12-21(13-9-18)29-25(32)17-36-23-7-5-4-6-20(23)16-24-26(33)31(2)28(37-24)30-22-14-10-19(11-15-22)27(34)35-3/h4-16H,17H2,1-3H3,(H,29,32)/b24-16+,30-28+InChIKey
OKVPBFLVRQBECB-BWOZNFONSA-NSynonyms
COC(=O)c1ccc(cc1)N=C1SC(=Cc2ccccc2OCC(=O)Nc2ccc(cc2)C)C(=O)N1C
methyl4(((2E5E)3methyl5(2(2((4methylphenyl)amino)2oxoethoxy)benzylidene)4oxo13thiazolidin2ylidene)amino)benzoate
MFCD04127331
ZINC000012628038
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