Vitas-M small molecule compound
ethyl 4-({(2Z,5E)-5-[4-(2-amino-2-oxoethoxy)-3-bromo-5-ethoxybenzylidene]-4-oxo-1,3-thiazolidin-2-ylidene}amino)benzoate
Catalog ID
STK959967
SMILES CCOC(=O)c1ccc(cc1)/N=C/1\S/C(=C/c2cc(Br)c(c(c2)OCC)OCC(=O)N)/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 C23H22BrN3O6S MW 548.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22BrN3O6S/c1-3-31-17-10-13(9-16(24)20(17)33-12-19(25)28)11-18-21(29)27-23(34-18)26-15-7-5-14(6-8-15)22(30)32-4-2/h5-11H,3-4,12H2,1-2H3,(H2,25,28)(H,26,27,29)/b18-11+InChIKey
IXUYUXHVNNLJBE-WOJGMQOQSA-NSynonyms
444937-44-4444937444
CCOC(=O)c1ccc(cc1)N=C1SC(=Cc2cc(Br)c(c(c2)OCC)OCC(=O)N)C(=O)N1
CCOC1=C(C(=CC(=C1)C=C2C(=O)N=C(S2)NC3=CC=C(C=C3)C(=O)OCC)Br)OCC(=O)N
ethyl4(((2Z5E)5(4(2amino2oxoethoxy)3bromo5ethoxybenzylidene)4oxo13thiazolidin2ylidene)amino)benzoate
ethyl4(((5E)5((4(2amino2oxoethoxy)3bromo5ethoxyphenyl)methylidene)4oxo13thiazol2yl)amino)benzoate
InChI=1SC23H22BrN3O6Sc1331171013(916(24)20(17)331219(25)28)111821(29)2723(3418)26157514(6815)22(30)3242h511H3412H212H3(H22528)(H262729)b1811+
MFCD02606738
ZINC000103070677
ZINC103070677
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