Vitas-M small molecule compound
ethyl 5-cyano-6-({2-[(3,4-dimethylphenyl)amino]-2-oxoethyl}sulfanyl)-4-(2-methoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyridine-3-carboxylate
Catalog ID
STK887407
SMILES CCOC(=O)C1C(=O)NC(=C(C1c1ccccc1OC)C#N)SCC(=O)Nc1ccc(c(c1)C)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 C26H27N3O5S MW 493.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N3O5S/c1-5-34-26(32)23-22(18-8-6-7-9-20(18)33-4)19(13-27)25(29-24(23)31)35-14-21(30)28-17-11-10-15(2)16(3)12-17/h6-12,22-23H,5,14H2,1-4H3,(H,28,30)(H,29,31)InChIKey
GRBOEEOQEYRHBF-UHFFFAOYSA-NSynonyms
370850-57-0370850570
CCOC(=O)C1C(C(=C(NC1=O)SCC(=O)NC2=CC(=C(C=C2)C)C)C#N)C3=CC=CC=C3OC
ethyl5cyano6((2((34dimethylphenyl)amino)2oxoethyl)sulfanyl)4(2methoxyphenyl)2oxo1234tetrahydropyridine3carboxylate
ethyl5cyano6((2((34dimethylphenyl)amino)2oxoethyl)thio)4(2methoxyphenyl)2oxo1234tetrahydropyridine3carboxylate
InChI=1SC26H27N3O5Sc153426(32)2322(18867920(18)334)19(1327)25(2924(23)31)351421(30)2817111015(2)16(3)1217h6122223H514H214H3(H2830)(H2931)
MFCD02999809
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