Vitas-M small molecule compound
diethyl 6,6'-(methanediyldisulfanediyl)bis[4-(2-chlorophenyl)-5-cyano-2-phenyl-1,4-dihydropyridine-3-carboxylate]
Catalog ID
STK886039
SMILES CCOC(=O)C1=C(NC(=C(C1c1ccccc1Cl)C#N)SCSC1=C(C#N)C(C(=C(N1)c1ccccc1)C(=O)OCC)c1ccccc1Cl)c1ccccc1
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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 C43H34Cl2N4O4S2 MW 805.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C43H34Cl2N4O4S2/c1-3-52-42(50)36-34(28-19-11-13-21-32(28)44)30(23-46)40(48-38(36)26-15-7-5-8-16-26)54-25-55-41-31(24-47)35(29-20-12-14-22-33(29)45)37(43(51)53-4-2)39(49-41)27-17-9-6-10-18-27/h5-22,34-35,48-49H,3-4,25H2,1-2H3InChIKey
KFTZEBZDTAILEQ-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(NC(=C(C1C2=CC=CC=C2Cl)C#N)SCSC3=C(C(C(=C(N3)C4=CC=CC=C4)C(=O)OCC)C5=CC=CC=C5Cl)C#N)C6=CC=CC=C6
diethyl66(methanediyldisulfanediyl)bis(4(2chlorophenyl)5cyano2phenyl14dihydropyridine3carboxylate)
ETHYL4(2CHLOROPHENYL)6((4(2CHLOROPHENYL)3CYANO5ETHOXYCARBONYL6PHENYL14DIHYDROPYRIDIN2YL)SULFANYLMETHYLSULFANYL)5CYANO2PHENYL14DIHYDROPYRIDINE3CARBOXYLATE
InChI=1SC43H34Cl2N4O4S2c135242(50)3634(281911132132(28)44)30(2346)40(4838(36)26157581626)5425554131(2447)35(292012142233(29)45)37(43(51)5342)39(4941)271796101827h52234354849H3425H212H3
MFCD06668701
ZINC000098045719
ZINC000098045721
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.