Vitas-M small molecule compound
methyl 2-[(2-{[4-phenyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}propanoyl)amino]benzoate
Catalog ID
STK301487
SMILES COC(=O)c1ccccc1NC(=O)C(Sc1nc(cc(n1)C(F)(F)F)c1ccccc1)C
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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 C22H18F3N3O3S MW 461.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18F3N3O3S/c1-13(19(29)26-16-11-7-6-10-15(16)20(30)31-2)32-21-27-17(14-8-4-3-5-9-14)12-18(28-21)22(23,24)25/h3-13H,1-2H3,(H,26,29)InChIKey
OAVFWKXKMXNVSE-UHFFFAOYSA-NSynonyms
438214-68-7438214687
CC(C(=O)NC1=CC=CC=C1C(=O)OC)SC2=NC(=CC(=N2)C(F)(F)F)C3=CC=CC=C3
InChI=1SC22H18F3N3O3Sc113(19(29)261611761015(16)20(30)312)32212717(148435914)1218(2821)22(2324)25h313H12H3(H2629)
methyl2((2((4phenyl6(trifluoromethyl)pyrimidin2yl)sulfanyl)propanoyl)amino)benzoate
METHYL2(2(4PHENYL6(TRIFLUOROMETHYL)PYRIMIDIN2YL)SULFANYLPROPANOYLAMINO)BENZOATE
MFCD03465383
ZINC000000650603
ZINC000000650604
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