Vitas-M small molecule compound
methyl 6-({2-[(5-chloro-2-methoxyphenyl)amino]-2-oxoethyl}sulfanyl)-4-(4-chlorophenyl)-5-cyano-2-oxo-1,2,3,4-tetrahydropyridine-3-carboxylate
Catalog ID
STK535773
SMILES COC(=O)C1C(=O)NC(=C(C1c1ccc(cc1)Cl)C#N)SCC(=O)Nc1cc(Cl)ccc1OC
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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 C23H19Cl2N3O5S MW 520.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19Cl2N3O5S/c1-32-17-8-7-14(25)9-16(17)27-18(29)11-34-22-15(10-26)19(12-3-5-13(24)6-4-12)20(21(30)28-22)23(31)33-2/h3-9,19-20H,11H2,1-2H3,(H,27,29)(H,28,30)InChIKey
QQKNXPUYASUKQE-UHFFFAOYSA-NSynonyms
COC1=C(C=C(C=C1)Cl)NC(=O)CSC2=C(C(C(C(=O)N2)C(=O)OC)C3=CC=C(C=C3)Cl)C#N
InChI=1SC23H19Cl2N3O5Sc132178714(25)916(17)2718(29)11342215(1026)19(123513(24)6412)20(21(30)2822)23(31)332h391920H11H212H3(H2729)(H2830)
methyl6((2((5chloro2methoxyphenyl)amino)2oxoethyl)sulfanyl)4(4chlorophenyl)5cyano2oxo1234tetrahydropyridine3carboxylate
methyl6((2((5chloro2methoxyphenyl)amino)2oxoethyl)thio)4(4chlorophenyl)5cyano2oxo1234tetrahydropyridine3carboxylate
METHYL6(2(5CHLORO2METHOXYANILINO)2OXOETHYL)SULFANYL4(4CHLOROPHENYL)5CYANO2OXO34DIHYDRO1HPYRIDINE3CARBOXYLATE
MFCD02236024
ZINC000002294330
ZINC000002294333
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