Vitas-M small molecule compound

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

Catalog ID
STL018848
SMILES CCOC(=O)c1ccc(cc1)/N=C/1\SC(CC(=O)N1C)C(=O)Nc1ccc(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 C21H20FN3O4S MW 429.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20FN3O4S/c1-3-29-20(28)13-4-8-16(9-5-13)24-21-25(2)18(26)12-17(30-21)19(27)23-15-10-6-14(22)7-11-15/h4-11,17H,3,12H2,1-2H3,(H,23,27)/b24-21-
InChIKey
AMAYHHYQYKBRFH-FLFQWRMESA-N
Synonyms
335419-50-6
(Z)ethyl4((6((4fluorophenyl)carbamoyl)3methyl4oxo13thiazinan2ylidene)amino)benzoate
335419506
CCOC(=O)c1ccc(cc1)N=C1SC(CC(=O)N1C)C(=O)Nc1ccc(cc1)F
ethyl4(((2Z)6((4fluorophenyl)carbamoyl)3methyl4oxo13thiazinan2ylidene)amino)benzoate
MFCD02146514
ZINC000000662216
ZINC000000662219

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Available files

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