Vitas-M small molecule compound
2-methoxyethyl 4-(4-chlorophenyl)-5-cyano-2-methyl-6-[(2-oxo-2-{[3-(trifluoromethyl)phenyl]amino}ethyl)sulfanyl]-1,4-dihydropyridine-3-carboxylate
Catalog ID
STK885758
SMILES COCCOC(=O)C1=C(C)NC(=C(C1c1ccc(cc1)Cl)C#N)SCC(=O)Nc1cccc(c1)C(F)(F)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 C26H23ClF3N3O4S MW 566.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23ClF3N3O4S/c1-15-22(25(35)37-11-10-36-2)23(16-6-8-18(27)9-7-16)20(13-31)24(32-15)38-14-21(34)33-19-5-3-4-17(12-19)26(28,29)30/h3-9,12,23,32H,10-11,14H2,1-2H3,(H,33,34)InChIKey
NGZFALJIHZCVGR-UHFFFAOYSA-NSynonyms
2methoxyethyl4(4chlorophenyl)5cyano2methyl6((2oxo2((3(trifluoromethyl)phenyl)amino)ethyl)sulfanyl)14dihydropyridine3carboxylate
2methoxyethyl4(4chlorophenyl)5cyano2methyl6((2oxo2((3(trifluoromethyl)phenyl)amino)ethyl)thio)14dihydropyridine3carboxylate
2METHOXYETHYL4(4CHLOROPHENYL)5CYANO2METHYL6(2OXO2(3(TRIFLUOROMETHYL)ANILINO)ETHYL)SULFANYL14DIHYDROPYRIDINE3CARBOXYLATE
CC1=C(C(C(=C(N1)SCC(=O)NC2=CC=CC(=C2)C(F)(F)F)C#N)C3=CC=C(C=C3)Cl)C(=O)OCCOC
InChI=1SC26H23ClF3N3O4Sc11522(25(35)371110362)23(166818(27)9716)20(1331)24(3215)381421(34)331953417(1219)26(2829)30h39122332H101114H212H3(H3334)
MFCD03668803
ZINC000001773035
ZINC000098000066
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