Vitas-M small molecule compound
bis(2-methylpropyl) 4-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-1H-pyrazol-4-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
Catalog ID
STK810475
SMILES CC(COC(=O)C1=C(C)NC(=C(C1c1cn(nc1c1ccc2c(c1)OCCO2)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 C34H39N3O6 MW 585.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H39N3O6/c1-20(2)18-42-33(38)29-22(5)35-23(6)30(34(39)43-19-21(3)4)31(29)26-17-37(25-10-8-7-9-11-25)36-32(26)24-12-13-27-28(16-24)41-15-14-40-27/h7-13,16-17,20-21,31,35H,14-15,18-19H2,1-6H3InChIKey
QXGAWXUSPSMDNE-UHFFFAOYSA-NSynonyms
bis(2methylpropyl)4(3(23dihydro14benzodioxin6yl)1phenyl1Hpyrazol4yl)26dimethyl14dihydropyridine35dicarboxylate
BIS(2METHYLPROPYL)4(3(23DIHYDRO14BENZODIOXIN6YL)1PHENYLPYRAZOL4YL)26DIMETHYL14DIHYDROPYRIDINE35DICARBOXYLATE
CC1=C(C(C(=C(N1)C)C(=O)OCC(C)C)C2=CN(N=C2C3=CC4=C(C=C3)OCCO4)C5=CC=CC=C5)C(=O)OCC(C)C
InChI=1SC34H39N3O6c120(2)184233(38)2922(5)3523(6)30(34(39)431921(3)4)31(29)261737(25108791125)3632(26)2412132728(1624)4115144027h713161720213135H14151819H216H3
MFCD04568580
ZINC000098047082
ZINC98047082
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