Vitas-M small molecule compound
4-(2-chlorophenyl)-6-hydroxy-2-[(naphthalen-1-ylmethyl)sulfanyl]-5-(thiophen-2-ylcarbonyl)-6-(trifluoromethyl)-1,4,5,6-tetrahydropyridine-3-carbonitrile
Catalog ID
STK537824
SMILES N#CC1=C(SCc2cccc3c2cccc3)NC(C(C1c1ccccc1Cl)C(=O)c1cccs1)(O)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 C29H20ClF3N2O2S2 MW 585.07 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H20ClF3N2O2S2/c30-22-12-4-3-11-20(22)24-21(15-34)27(39-16-18-9-5-8-17-7-1-2-10-19(17)18)35-28(37,29(31,32)33)25(24)26(36)23-13-6-14-38-23/h1-14,24-25,35,37H,16H2InChIKey
VWKOASBKCUSXTN-UHFFFAOYSA-NSynonyms
4(2CHLOROPHENYL)2HYDROXY6(NAPHTHALEN1YLMETHYLSULFANYL)3(THIOPHENE2CARBONYL)2(TRIFLUOROMETHYL)34DIHYDRO1HPYRIDINE5CARBONITRILE
4(2chlorophenyl)6hydroxy2((naphthalen1ylmethyl)sulfanyl)5(thiophen2ylcarbonyl)6(trifluoromethyl)1456tetrahydropyridine3carbonitrile
4(2chlorophenyl)6hydroxy2((naphthalen1ylmethyl)thio)5(thiophene2carbonyl)6(trifluoromethyl)1456tetrahydropyridine3carbonitrile
C1=CC=C2C(=C1)C=CC=C2CSC3=C(C(C(C(N3)(C(F)(F)F)O)C(=O)C4=CC=CS4)C5=CC=CC=C5Cl)C#N
InChI=1SC29H20ClF3N2O2S2c302212431120(22)2421(1534)27(391618958177121019(17)18)3528(3729(3132)33)25(24)26(36)23136143823h11424253537H16H2
MFCD02236604
ZINC000053334788
ZINC000229916768
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