Vitas-M small molecule compound
2-[(5-bromo-2-methoxy-4-{(Z)-[(2E)-3-methyl-2-(methylimino)-4-oxo-1,3-thiazolidin-5-ylidene]methyl}phenoxy)methyl]benzonitrile
Catalog ID
STK153602
SMILES C/N=C\1/S/C(=C\c2cc(OC)c(cc2Br)OCc2ccccc2C#N)/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 C21H18BrN3O3S MW 472.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18BrN3O3S/c1-24-21-25(2)20(26)19(29-21)9-15-8-17(27-3)18(10-16(15)22)28-12-14-7-5-4-6-13(14)11-23/h4-10H,12H2,1-3H3/b19-9-,24-21+InChIKey
ZDOCJKHODZHDNI-RORGJZCMSA-NSynonyms
2((5bromo2methoxy4((Z)((2E)3methyl2(methylimino)4oxo13thiazolidin5ylidene)methyl)phenoxy)methyl)benzonitrile
CN=C1SC(=Cc2cc(OC)c(cc2Br)OCc2ccccc2C#N)C(=O)N1C
MFCD03241027
ZINC000009720726
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