Vitas-M small molecule compound
di-tert-butyl 4-[3-(3-fluoro-4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
Catalog ID
STK810694
SMILES COc1ccc(cc1F)c1nn(cc1C1C(=C(C)NC(=C1C(=O)OC(C)(C)C)C)C(=O)OC(C)(C)C)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 C33H38FN3O5 MW 575.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H38FN3O5/c1-19-26(30(38)41-32(3,4)5)28(27(20(2)35-19)31(39)42-33(6,7)8)23-18-37(22-13-11-10-12-14-22)36-29(23)21-15-16-25(40-9)24(34)17-21/h10-18,28,35H,1-9H3InChIKey
XJKLPESHALWIQY-UHFFFAOYSA-NSynonyms
CC1=C(C(C(=C(N1)C)C(=O)OC(C)(C)C)C2=CN(N=C2C3=CC(=C(C=C3)OC)F)C4=CC=CC=C4)C(=O)OC(C)(C)C
ditertbutyl4(3(3fluoro4methoxyphenyl)1phenyl1Hpyrazol4yl)26dimethyl14dihydropyridine35dicarboxylate
DITERTBUTYL4(3(3FLUORO4METHOXYPHENYL)1PHENYLPYRAZOL4YL)26DIMETHYL14DIHYDROPYRIDINE35DICARBOXYLATE
InChI=1SC33H38FN3O5c11926(30(38)4132(34)5)28(27(20(2)3519)31(39)4233(67)8)231837(22131110121422)3629(23)21151625(409)24(34)1721h10182835H19H3
MFCD04489638
ZINC000098047098
ZINC98047098
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