Vitas-M small molecule compound

methyl 4-({[(2Z)-3-[2-(4-fluorophenyl)ethyl]-4-oxo-2-(phenylimino)-1,3-thiazinan-6-yl]carbonyl}amino)benzoate

Catalog ID
STK732581
SMILES COC(=O)c1ccc(cc1)NC(=O)C1CC(=O)N(/C(=N/c2ccccc2)/S1)CCc1ccc(cc1)F

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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 C27H24FN3O4S MW 505.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H24FN3O4S/c1-35-26(34)19-9-13-22(14-10-19)29-25(33)23-17-24(32)31(16-15-18-7-11-20(28)12-8-18)27(36-23)30-21-5-3-2-4-6-21/h2-14,23H,15-17H2,1H3,(H,29,33)/b30-27-
InChIKey
DEZCRWLJGPAHQS-IKPAITLHSA-N
Synonyms
522649-97-4
(Z)methyl4(3(4fluorophenethyl)4oxo2(phenylimino)13thiazinane6carboxamido)benzoate
522649974
COC(=O)c1ccc(cc1)NC(=O)C1CC(=O)N(C(=Nc2ccccc2)S1)CCc1ccc(cc1)F
methyl4((((2Z)3(2(4fluorophenyl)ethyl)4oxo2(phenylimino)13thiazinan6yl)carbonyl)amino)benzoate
MFCD03487367
ZINC000009075953
ZINC000009075954

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Available files

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