Vitas-M small molecule compound
4-({[(2Z)-3-methyl-4-oxo-2-{[3-(trifluoromethyl)phenyl]imino}-1,3-thiazinan-6-yl]carbonyl}amino)benzoic acid
Catalog ID
STK038003
SMILES O=C(C1CC(=O)N(/C(=N/c2cccc(c2)C(F)(F)F)/S1)C)Nc1ccc(cc1)C(=O)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 C20H16F3N3O4S MW 451.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16F3N3O4S/c1-26-16(27)10-15(17(28)24-13-7-5-11(6-8-13)18(29)30)31-19(26)25-14-4-2-3-12(9-14)20(21,22)23/h2-9,15H,10H2,1H3,(H,24,28)(H,29,30)/b25-19-InChIKey
AXXTXFPIZCXIHR-PLRJNAJWSA-NSynonyms
442554-79-2(E)4(3methyl4oxo2((3(trifluoromethyl)phenyl)imino)13thiazinane6carboxamido)benzoicacid
4((((2Z)3methyl4oxo2((3(trifluoromethyl)phenyl)imino)13thiazinan6yl)carbonyl)amino)benzoicacid
442554792
MFCD03057697
O=C(C1CC(=O)N(C(=Nc2cccc(c2)C(F)(F)F)S1)C)Nc1ccc(cc1)C(=O)O
STK038003
ZINC000013688288
ZINC000100262340
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