Vitas-M small molecule compound
diethyl 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
STK810074
SMILES CCOC(=O)C1=C(C)NC(=C(C1c1cn(nc1c1ccc2c(c1)OCCO2)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 C30H31N3O6 MW 529.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H31N3O6/c1-5-36-29(34)25-18(3)31-19(4)26(30(35)37-6-2)27(25)22-17-33(21-10-8-7-9-11-21)32-28(22)20-12-13-23-24(16-20)39-15-14-38-23/h7-13,16-17,27,31H,5-6,14-15H2,1-4H3InChIKey
AKXGNTAEDHJUGQ-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(NC(=C(C1C2=CN(N=C2C3=CC4=C(C=C3)OCCO4)C5=CC=CC=C5)C(=O)OCC)C)C
diethyl4(3(23dihydro14benzodioxin6yl)1phenyl1Hpyrazol4yl)26dimethyl14dihydropyridine35dicarboxylate
DIETHYL4(3(23DIHYDRO14BENZODIOXIN6YL)1PHENYLPYRAZOL4YL)26DIMETHYL14DIHYDROPYRIDINE35DICARBOXYLATE
InChI=1SC30H31N3O6c153629(34)2518(3)3119(4)26(30(35)3762)27(25)221733(21108791121)3228(22)2012132324(1620)3915143823h71316172731H561415H214H3
MFCD03462447
ZINC000001477084
ZINC01477084
ZINC1477084
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