Vitas-M small molecule compound
diprop-2-en-1-yl 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
STK810439
SMILES C=CCOC(=O)C1=C(C)NC(=C(C1c1cn(nc1c1ccc2c(c1)OCCO2)c1ccccc1)C(=O)OCC=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 C32H31N3O6 MW 553.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H31N3O6/c1-5-14-40-31(36)27-20(3)33-21(4)28(32(37)41-15-6-2)29(27)24-19-35(23-10-8-7-9-11-23)34-30(24)22-12-13-25-26(18-22)39-17-16-38-25/h5-13,18-19,29,33H,1-2,14-17H2,3-4H3InChIKey
LCILCTBQVBCFSN-UHFFFAOYSA-NSynonyms
35BIS(PROP2EN1YL)4(3(23DIHYDRO14BENZODIOXIN6YL)1PHENYL1HPYRAZOL4YL)26DIMETHYL14DIHYDROPYRIDINE35DICARBOXYLATE
BIS(PROP2ENYL)4(3(23DIHYDRO14BENZODIOXIN6YL)1PHENYLPYRAZOL4YL)26DIMETHYL14DIHYDROPYRIDINE35DICARBOXYLATE
CC1=C(C(C(=C(N1)C)C(=O)OCC=C)C2=CN(N=C2C3=CC4=C(C=C3)OCCO4)C5=CC=CC=C5)C(=O)OCC=C
diprop2en1yl4(3(23dihydro14benzodioxin6yl)1phenyl1Hpyrazol4yl)26dimethyl14dihydropyridine35dicarboxylate
InChI=1SC32H31N3O6c15144031(36)2720(3)3321(4)28(32(37)411562)29(27)241935(23108791123)3430(24)2212132526(1822)3917163825h51318192933H121417H234H3
MFCD04601317
ZINC000097956792
ZINC97956792
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