Vitas-M small molecule compound
diethyl 4-[3-(3-bromo-4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
Catalog ID
STK706258
SMILES CCOC(=O)C1=C(C)NC(=C(C1c1cn(nc1c1ccc(c(c1)Br)OC)c1ccccc1)C(=O)OCC)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 C29H30BrN3O5 MW 580.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H30BrN3O5/c1-6-37-28(34)24-17(3)31-18(4)25(29(35)38-7-2)26(24)21-16-33(20-11-9-8-10-12-20)32-27(21)19-13-14-23(36-5)22(30)15-19/h8-16,26,31H,6-7H2,1-5H3InChIKey
JGQSJEHCWFXHLD-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(NC(=C(C1C2=CN(N=C2C3=CC(=C(C=C3)OC)Br)C4=CC=CC=C4)C(=O)OCC)C)C
diethyl4(3(3bromo4methoxyphenyl)1phenyl1Hpyrazol4yl)26dimethyl14dihydropyridine35dicarboxylate
DIETHYL4(3(3BROMO4METHOXYPHENYL)1PHENYLPYRAZOL4YL)26DIMETHYL14DIHYDROPYRIDINE35DICARBOXYLATE
InChI=1SC29H30BrN3O5c163728(34)2417(3)3118(4)25(29(35)3872)26(24)211633(201198101220)3227(21)19131423(365)22(30)1519h8162631H67H215H3
MFCD01956545
ZINC000100740692
ZINC100740692
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