Vitas-M small molecule compound
ethyl 6-({2-[(4-chloro-2,5-dimethoxyphenyl)amino]-2-oxoethyl}sulfanyl)-5-cyano-4-(2-methoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyridine-3-carboxylate
Catalog ID
STK887406
SMILES CCOC(=O)C1C(=O)NC(=C(C1c1ccccc1OC)C#N)SCC(=O)Nc1cc(OC)c(cc1OC)Cl
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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 C26H26ClN3O7S MW 560.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26ClN3O7S/c1-5-37-26(33)23-22(14-8-6-7-9-18(14)34-2)15(12-28)25(30-24(23)32)38-13-21(31)29-17-11-19(35-3)16(27)10-20(17)36-4/h6-11,22-23H,5,13H2,1-4H3,(H,29,31)(H,30,32)InChIKey
YCICIGFMXKYNKG-UHFFFAOYSA-NSynonyms
CCOC(=O)C1C(C(=C(NC1=O)SCC(=O)NC2=CC(=C(C=C2OC)Cl)OC)C#N)C3=CC=CC=C3OC
ethyl6((2((4chloro25dimethoxyphenyl)amino)2oxoethyl)sulfanyl)5cyano4(2methoxyphenyl)2oxo1234tetrahydropyridine3carboxylate
ethyl6((2((4chloro25dimethoxyphenyl)amino)2oxoethyl)thio)5cyano4(2methoxyphenyl)2oxo1234tetrahydropyridine3carboxylate
ETHYL6(2(4CHLORO25DIMETHOXYANILINO)2OXOETHYL)SULFANYL5CYANO4(2METHOXYPHENYL)2OXO34DIHYDRO1HPYRIDINE3CARBOXYLATE
InChI=1SC26H26ClN3O7Sc153726(33)2322(14867918(14)342)15(1228)25(3024(23)32)381321(31)29171119(353)16(27)1020(17)364h6112223H513H214H3(H2931)(H3032)
MFCD03001074
ZINC000001885579
ZINC000001885586
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