Vitas-M small molecule compound
ethyl (5-bromo-2-methoxy-4-{(E)-[(2Z)-4-oxo-2-(phenylimino)-1,3-thiazolidin-5-ylidene]methyl}phenoxy)acetate
Catalog ID
STK960515
SMILES CCOC(=O)COc1cc(Br)c(cc1OC)/C=C\1/S/C(=N\c2ccccc2)/NC1=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 C21H19BrN2O5S MW 491.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19BrN2O5S/c1-3-28-19(25)12-29-17-11-15(22)13(9-16(17)27-2)10-18-20(26)24-21(30-18)23-14-7-5-4-6-8-14/h4-11H,3,12H2,1-2H3,(H,23,24,26)/b18-10+InChIKey
TUBMEYYNBBZEJP-VCHYOVAHSA-NSynonyms
495386-13-5495386135
CCOC(=O)COC1=C(C=C(C(=C1)Br)C=C2C(=O)N=C(S2)NC3=CC=CC=C3)OC
CCOC(=O)COc1cc(Br)c(cc1OC)C=C1SC(=Nc2ccccc2)NC1=O
ethyl(5bromo2methoxy4((E)((2Z)4oxo2(phenylimino)13thiazolidin5ylidene)methyl)phenoxy)acetate
ethyl2(4((E)(2anilino4oxo13thiazol5ylidene)methyl)5bromo2methoxyphenoxy)acetate
InChI=1SC21H19BrN2O5Sc132819(25)1229171115(22)13(916(17)272)101820(26)2421(3018)23147546814h411H312H212H3(H232426)b1810+
MFCD02608202
ZINC000001001965
ZINC01001965
ZINC1001965
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