Vitas-M small molecule compound

diethyl 4-{3-[4-(hexyloxy)phenyl]-1-phenyl-1H-pyrazol-4-yl}-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate

Catalog ID
STK810073
SMILES CCCCCCOc1ccc(cc1)c1nn(cc1C1C(=C(C)NC(=C1C(=O)OCC)C)C(=O)OCC)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 C34H41N3O5 MW 571.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H41N3O5/c1-6-9-10-14-21-42-27-19-17-25(18-20-27)32-28(22-37(36-32)26-15-12-11-13-16-26)31-29(33(38)40-7-2)23(4)35-24(5)30(31)34(39)41-8-3/h11-13,15-20,22,31,35H,6-10,14,21H2,1-5H3
InChIKey
WUBFHJRZSITBGJ-UHFFFAOYSA-N
Synonyms

CCCCCCOC1=CC=C(C=C1)C2=NN(C=C2C3C(=C(NC(=C3C(=O)OCC)C)C)C(=O)OCC)C4=CC=CC=C4
diethyl4(3(4(hexyloxy)phenyl)1phenyl1Hpyrazol4yl)26dimethyl14dihydropyridine35dicarboxylate
DIETHYL4(3(4HEXOXYPHENYL)1PHENYLPYRAZOL4YL)26DIMETHYL14DIHYDROPYRIDINE35DICARBOXYLATE
InChI=1SC34H41N3O5c1691014214227191725(182027)3228(2237(3632)26151211131626)3129(33(38)4072)23(4)3524(5)30(31)34(39)4183h11131520223135H6101421H215H3
MFCD03462446
ZINC000098047054
ZINC98047054

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Available files

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