Vitas-M small molecule compound
ethyl 6-({2-[(4-bromophenyl)amino]-2-oxoethyl}sulfanyl)-5-cyano-4-(2-methoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyridine-3-carboxylate
Catalog ID
STK827122
SMILES CCOC(=O)C1C(=O)NC(=C(C1c1ccccc1OC)C#N)SCC(=O)Nc1ccc(cc1)Br
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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 C24H22BrN3O5S MW 544.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22BrN3O5S/c1-3-33-24(31)21-20(16-6-4-5-7-18(16)32-2)17(12-26)23(28-22(21)30)34-13-19(29)27-15-10-8-14(25)9-11-15/h4-11,20-21H,3,13H2,1-2H3,(H,27,29)(H,28,30)InChIKey
JPJHXJHWHQAMKZ-UHFFFAOYSA-NSynonyms
384357-50-0384357500
CCOC(=O)C1C(C(=C(NC1=O)SCC(=O)NC2=CC=C(C=C2)Br)C#N)C3=CC=CC=C3OC
ethyl6((2((4bromophenyl)amino)2oxoethyl)sulfanyl)5cyano4(2methoxyphenyl)2oxo1234tetrahydropyridine3carboxylate
ethyl6((2((4bromophenyl)amino)2oxoethyl)thio)5cyano4(2methoxyphenyl)2oxo1234tetrahydropyridine3carboxylate
ETHYL6(2(4BROMOANILINO)2OXOETHYL)SULFANYL5CYANO4(2METHOXYPHENYL)2OXO34DIHYDRO1HPYRIDINE3CARBOXYLATE
InChI=1SC24H22BrN3O5Sc133324(31)2120(16645718(16)322)17(1226)23(2822(21)30)341319(29)271510814(25)91115h4112021H313H212H3(H2729)(H2830)
MFCD03000969
ZINC000002312523
ZINC000002312526
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