ethyl 5-[4-[4-(2-methylbutanoyl)piperazin-1-yl]phenyl]-1-pyridin-2-yl-pyrazole-3-carboxylate

Systemtic Name: ethyl 5-[4-[4-(2-methylbutanoyl)piperazin-1-yl]phenyl]-1-pyridin-2-yl-pyrazole-3-carboxylate Openeye Name: ethyl 5-[4-[4-(2-methylbutanoyl)piperazin-1-yl]phenyl]-1-(2-pyridyl)pyrazole-3-carboxylate CAS Name: 5-[4-[4-(2-methyl-1-oxobutyl)-1-piperazinyl]phenyl]-1-(2-pyridinyl)-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[4-[4-(2-methylbutanoyl)piperazin-1-yl]phenyl]-1-pyridin-2-ylpyrazole-3-carboxylate Traditional Name: 5-[4-[4-(2-methylbutanoyl)piperazino]phenyl]-1-(2-pyridyl)pyrazole-3-carboxylic acid ethyl ester Formula: C26H31N5O3 MolecularWeight: 461.55604

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(=O)N1CCN(CC1)C2=CC=C(C=C2)C3=CC(=NN3C4=CC=CC=N4)C(=O)OCC

Isomeric SMILES

CCC(C)C(=O)N1CCN(CC1)C2=CC=C(C=C2)C3=CC(=NN3C4=CC=CC=N4)C(=O)OCC

InChI

InChI=1S/C26H31N5O3/c1-4-19(3)25(32)30-16-14-29(15-17-30)21-11-9-20(10-12-21)23-18-22(26(33)34-5-2)28-31(23)24-8-6-7-13-27-24/h6-13,18-19H,4-5,14-17H2,1-3H3