Vitas-M small molecule compound

bis(2-methylpropyl) 4-[3-(4-ethoxy-3-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate

Catalog ID
STK821369
SMILES CCOc1ccc(cc1[N+](=O)[O-])c1nn(cc1C1C(=C(C)NC(=C1C(=O)OCC(C)C)C)C(=O)OCC(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 C34H40N4O7 MW 616.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H40N4O7/c1-8-43-28-15-14-24(16-27(28)38(41)42)32-26(17-37(36-32)25-12-10-9-11-13-25)31-29(33(39)44-18-20(2)3)22(6)35-23(7)30(31)34(40)45-19-21(4)5/h9-17,20-21,31,35H,8,18-19H2,1-7H3
InChIKey
ZCMYSEAHMHVUCF-UHFFFAOYSA-N
Synonyms

bis(2methylpropyl)4(3(4ethoxy3nitrophenyl)1phenyl1Hpyrazol4yl)26dimethyl14dihydropyridine35dicarboxylate
BIS(2METHYLPROPYL)4(3(4ETHOXY3NITROPHENYL)1PHENYLPYRAZOL4YL)26DIMETHYL14DIHYDROPYRIDINE35DICARBOXYLATE
CCOC1=C(C=C(C=C1)C2=NN(C=C2C3C(=C(NC(=C3C(=O)OCC(C)C)C)C)C(=O)OCC(C)C)C4=CC=CC=C4)(N+)(=O)(O)
CCOc1ccc(cc1(N+)(=O)(O))c1nn(cc1C1C(=C(C)NC(=C1C(=O)OCC(C)C)C)C(=O)OCC(C)C)c1ccccc1
InChI=1SC34H40N4O7c184328151424(1627(28)38(41)42)3226(1737(3632)2512109111325)3129(33(39)441820(2)3)22(6)3523(7)30(31)34(40)451921(4)5h91720213135H81819H217H3
MFCD03088732
ZINC000100738169
ZINC100738169

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Available files

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