Vitas-M small molecule compound
5-cyano-N-(2,4-dichlorophenyl)-4-(furan-2-yl)-2-methyl-6-[(2-oxo-2-{[3-(trifluoromethyl)phenyl]amino}ethyl)sulfanyl]-1,4-dihydropyridine-3-carboxamide
Catalog ID
STK885826
SMILES N#CC1=C(SCC(=O)Nc2cccc(c2)C(F)(F)F)NC(=C(C1c1ccco1)C(=O)Nc1ccc(cc1Cl)Cl)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 C27H19Cl2F3N4O3S MW 607.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H19Cl2F3N4O3S/c1-14-23(25(38)36-20-8-7-16(28)11-19(20)29)24(21-6-3-9-39-21)18(12-33)26(34-14)40-13-22(37)35-17-5-2-4-15(10-17)27(30,31)32/h2-11,24,34H,13H2,1H3,(H,35,37)(H,36,38)InChIKey
QJZCJBVVDXACHT-UHFFFAOYSA-NSynonyms
5cyanoN(24dichlorophenyl)4(furan2yl)2methyl6((2oxo2((3(trifluoromethyl)phenyl)amino)ethyl)sulfanyl)14dihydropyridine3carboxamide
5cyanoN(24dichlorophenyl)4(furan2yl)2methyl6(2oxo2(3(trifluoromethyl)anilino)ethyl)sulfanyl14dihydropyridine3carboxamide
CC1=C(C(C(=C(N1)SCC(=O)NC2=CC=CC(=C2)C(F)(F)F)C#N)C3=CC=CO3)C(=O)NC4=C(C=C(C=C4)Cl)Cl
InChI=1SC27H19Cl2F3N4O3Sc11423(25(38)36208716(28)1119(20)29)24(216393921)18(1233)26(3414)401322(37)351752415(1017)27(3031)32h2112434H13H21H3(H3537)(H3638)
MFCD10086361
ZINC000098048602
ZINC000098048603
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