Vitas-M small molecule compound
benzyl 4-(4-chlorophenyl)-6-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-5-cyano-2-methyl-1,4-dihydropyridine-3-carboxylate
Catalog ID
STK885922
SMILES N#CC1=C(SCC(=O)c2ccc(cc2)Cl)NC(=C(C1c1ccc(cc1)Cl)C(=O)OCc1ccccc1)C
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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 C29H22Cl2N2O3S MW 549.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H22Cl2N2O3S/c1-18-26(29(35)36-16-19-5-3-2-4-6-19)27(21-9-13-23(31)14-10-21)24(15-32)28(33-18)37-17-25(34)20-7-11-22(30)12-8-20/h2-14,27,33H,16-17H2,1H3InChIKey
VGZOGSCAPFYDDZ-UHFFFAOYSA-NSynonyms
benzyl4(4chlorophenyl)6((2(4chlorophenyl)2oxoethyl)sulfanyl)5cyano2methyl14dihydropyridine3carboxylate
benzyl4(4chlorophenyl)6(2(4chlorophenyl)2oxoethyl)sulfanyl5cyano2methyl14dihydropyridine3carboxylate
CC1=C(C(C(=C(N1)SCC(=O)C2=CC=C(C=C2)Cl)C#N)C3=CC=C(C=C3)Cl)C(=O)OCC4=CC=CC=C4
InChI=1SC29H22Cl2N2O3Sc11826(29(35)3616195324619)27(2191323(31)141021)24(1532)28(3318)371725(34)2071122(30)12820h2142733H1617H21H3
MFCD10086472
ZINC000098048739
ZINC000098048740
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