Vitas-M small molecule compound
methyl 5-cyano-4-(2-fluorophenyl)-2-oxo-6-({2-oxo-2-[(2,4,6-trimethylphenyl)amino]ethyl}sulfanyl)-1,2,3,4-tetrahydropyridine-3-carboxylate
Catalog ID
STK842094
SMILES COC(=O)C1C(=O)NC(=C(C1c1ccccc1F)C#N)SCC(=O)Nc1c(C)cc(cc1C)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 C25H24FN3O4S MW 481.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24FN3O4S/c1-13-9-14(2)22(15(3)10-13)28-19(30)12-34-24-17(11-27)20(16-7-5-6-8-18(16)26)21(23(31)29-24)25(32)33-4/h5-10,20-21H,12H2,1-4H3,(H,28,30)(H,29,31)InChIKey
ACBGMZKULYUMNX-UHFFFAOYSA-NSynonyms
497246-35-2497246352
CC1=CC(=C(C(=C1)C)NC(=O)CSC2=C(C(C(C(=O)N2)C(=O)OC)C3=CC=CC=C3F)C#N)C
InChI=1SC25H24FN3O4Sc113914(2)22(15(3)1013)2819(30)12342417(1127)20(16756818(16)26)21(23(31)2924)25(32)334h5102021H12H214H3(H2830)(H2931)
methyl5cyano4(2fluorophenyl)2oxo6((2oxo2((246trimethylphenyl)amino)ethyl)sulfanyl)1234tetrahydropyridine3carboxylate
METHYL5CYANO4(2FLUOROPHENYL)2OXO6(2OXO2(246TRIMETHYLANILINO)ETHYL)SULFANYL34DIHYDRO1HPYRIDINE3CARBOXYLATE
methyl5cyano4(2fluorophenyl)6((2(mesitylamino)2oxoethyl)thio)2oxo1234tetrahydropyridine3carboxylate
MFCD03298058
ZINC000009379747
ZINC000010007459
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