Vitas-M small molecule compound

methyl 4-[({(2Z)-3-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(2-fluorophenyl)imino]-4-oxo-1,3-thiazolidin-5-yl}acetyl)amino]benzoate

Catalog ID
STK164423
SMILES COC(=O)c1ccc(cc1)NC(=O)CC1S/C(=N\c2ccccc2F)/N(C1=O)CCc1ccc(c(c1)OC)OC

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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 C29H28FN3O6S MW 565.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28FN3O6S/c1-37-23-13-8-18(16-24(23)38-2)14-15-33-27(35)25(40-29(33)32-22-7-5-4-6-21(22)30)17-26(34)31-20-11-9-19(10-12-20)28(36)39-3/h4-13,16,25H,14-15,17H2,1-3H3,(H,31,34)/b32-29-
InChIKey
YDXPCRZDPYKWNY-OVXWJCGASA-N
Synonyms

COC(=O)c1ccc(cc1)NC(=O)CC1SC(=Nc2ccccc2F)N(C1=O)CCc1ccc(c(c1)OC)OC
methyl4((((2Z)3(2(34dimethoxyphenyl)ethyl)2((2fluorophenyl)imino)4oxo13thiazolidin5yl)acetyl)amino)benzoate
MFCD06164954
ZINC000097960349
ZINC000097960350

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Available files

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