Vitas-M small molecule compound

methyl 4-(2-chlorophenyl)-5-cyano-6-({2-[(4-ethoxyphenyl)amino]-2-oxoethyl}sulfanyl)-2-hydroxy-3,4-dihydropyridine-3-carboxylate

Catalog ID
STK846671
SMILES CCOc1ccc(cc1)NC(=O)CSC1=C(C#N)C(C(C(=N1)O)C(=O)OC)c1ccccc1Cl

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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 C24H22ClN3O5S MW 499.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22ClN3O5S/c1-3-33-15-10-8-14(9-11-15)27-19(29)13-34-23-17(12-26)20(16-6-4-5-7-18(16)25)21(22(30)28-23)24(31)32-2/h4-11,20-21H,3,13H2,1-2H3,(H,27,29)(H,28,30)
InChIKey
CIRWYFGRXWSLRQ-UHFFFAOYSA-N
Synonyms
369396-55-4
CCOC1=CC=C(C=C1)NC(=O)CSC2=C(C(C(C(=O)N2)C(=O)OC)C3=CC=CC=C3Cl)C#N
InChI=1SC24H22ClN3O5Sc13331510814(91115)2719(29)13342317(1226)20(16645718(16)25)21(22(30)2823)24(31)322h4112021H313H212H3(H2729)(H2830)
methyl4(2chlorophenyl)5cyano6((2((4ethoxyphenyl)amino)2oxoethyl)sulfanyl)2hydroxy34dihydropyridine3carboxylate
MFCD03807234

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.