Vitas-M small molecule compound
ethyl 4-({[(2Z)-3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-2-{[3-(trifluoromethyl)phenyl]imino}-1,3-thiazinan-6-yl]carbonyl}amino)benzoate
Catalog ID
STL069838
SMILES CCOC(=O)c1ccc(cc1)NC(=O)C1CC(=O)N(/C(=N/c2cccc(c2)C(F)(F)F)/S1)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 C31H30F3N3O6S MW 629.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H30F3N3O6S/c1-4-43-29(40)20-9-11-22(12-10-20)35-28(39)26-18-27(38)37(15-14-19-8-13-24(41-2)25(16-19)42-3)30(44-26)36-23-7-5-6-21(17-23)31(32,33)34/h5-13,16-17,26H,4,14-15,18H2,1-3H3,(H,35,39)/b36-30-InChIKey
MGHLAILJOFWWKB-BBTNWVSFSA-NSynonyms
(Z)ethyl4(3(34dimethoxyphenethyl)4oxo2((3(trifluoromethyl)phenyl)imino)13thiazinane6carboxamido)benzoate
CCOC(=O)c1ccc(cc1)NC(=O)C1CC(=O)N(C(=Nc2cccc(c2)C(F)(F)F)S1)CCc1ccc(c(c1)OC)OC
ethyl4((((2Z)3(2(34dimethoxyphenyl)ethyl)4oxo2((3(trifluoromethyl)phenyl)imino)13thiazinan6yl)carbonyl)amino)benzoate
MFCD02145646
ZINC000100217172
ZINC000100217178
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