methyl 4-[1-(4-chlorophenyl)-4-pyridin-4-yl-pyrazol-3-yl]piperazine-1-carboxylate

Systemtic Name: methyl 4-[1-(4-chlorophenyl)-4-pyridin-4-yl-pyrazol-3-yl]piperazine-1-carboxylate Openeye Name: methyl 4-[1-(4-chlorophenyl)-4-(4-pyridyl)pyrazol-3-yl]piperazine-1-carboxylate CAS Name: 4-[1-(4-chlorophenyl)-4-pyridin-4-yl-3-pyrazolyl]-1-piperazinecarboxylic acid methyl ester IUPAC Name: methyl 4-[1-(4-chlorophenyl)-4-pyridin-4-ylpyrazol-3-yl]piperazine-1-carboxylate Traditional Name: 4-[1-(4-chlorophenyl)-4-(4-pyridyl)pyrazol-3-yl]piperazine-1-carboxylic acid methyl ester Formula: C20H20ClN5O2 MolecularWeight: 397.8581

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N1CCN(CC1)C2=NN(C=C2C3=CC=NC=C3)C4=CC=C(C=C4)Cl

Isomeric SMILES

COC(=O)N1CCN(CC1)C2=NN(C=C2C3=CC=NC=C3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C20H20ClN5O2/c1-28-20(27)25-12-10-24(11-13-25)19-18(15-6-8-22-9-7-15)14-26(23-19)17-4-2-16(21)3-5-17/h2-9,14H,10-13H2,1H3