Vitas-M small molecule compound

methyl 4-{[(2E,5E)-5-{4-[(4-bromobenzyl)oxy]benzylidene}-3-ethyl-4-oxo-1,3-thiazolidin-2-ylidene]amino}benzoate

Catalog ID
STK109958
SMILES CCN1/C(=N\c2ccc(cc2)C(=O)OC)/S/C(=C/c2ccc(cc2)OCc2ccc(cc2)Br)/C1=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 C27H23BrN2O4S MW 551.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23BrN2O4S/c1-3-30-25(31)24(35-27(30)29-22-12-8-20(9-13-22)26(32)33-2)16-18-6-14-23(15-7-18)34-17-19-4-10-21(28)11-5-19/h4-16H,3,17H2,1-2H3/b24-16+,29-27+
InChIKey
UGLFSOIMTIODBP-NEQGSXNKSA-N
Synonyms

CCN1C(=Nc2ccc(cc2)C(=O)OC)SC(=Cc2ccc(cc2)OCc2ccc(cc2)Br)C1=O
methyl4(((2E5E)5(4((4bromobenzyl)oxy)benzylidene)3ethyl4oxo13thiazolidin2ylidene)amino)benzoate
MFCD04126811
ZINC000100233443

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.