Vitas-M small molecule compound
bis(2-methylpropyl) 4-{3-[4-(benzyloxy)-3-methylphenyl]-1-phenyl-1H-pyrazol-4-yl}-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
Catalog ID
STK880907
SMILES CC(COC(=O)C1=C(C)NC(=C(C1c1cn(nc1c1ccc(c(c1)C)OCc1ccccc1)c1ccccc1)C(=O)OCC(C)C)C)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 C40H45N3O5 MW 647.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C40H45N3O5/c1-25(2)22-47-39(44)35-28(6)41-29(7)36(40(45)48-23-26(3)4)37(35)33-21-43(32-16-12-9-13-17-32)42-38(33)31-18-19-34(27(5)20-31)46-24-30-14-10-8-11-15-30/h8-21,25-26,37,41H,22-24H2,1-7H3InChIKey
FBIXJNMCCQIXFR-UHFFFAOYSA-NSynonyms
bis(2methylpropyl)26dimethyl4(3(3methyl4phenylmethoxyphenyl)1phenylpyrazol4yl)14dihydropyridine35dicarboxylate
bis(2methylpropyl)4(3(4(benzyloxy)3methylphenyl)1phenyl1Hpyrazol4yl)26dimethyl14dihydropyridine35dicarboxylate
CC1=C(C=CC(=C1)C2=NN(C=C2C3C(=C(NC(=C3C(=O)OCC(C)C)C)C)C(=O)OCC(C)C)C4=CC=CC=C4)OCC5=CC=CC=C5
InChI=1SC40H45N3O5c125(2)224739(44)3528(6)4129(7)36(40(45)482326(3)4)37(35)332143(3216129131732)4238(33)31181934(27(5)2031)46243014108111530h82125263741H2224H217H3
MFCD03513459
ZINC000150404603
ZINC150404603
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