methyl 4-[5-(4-chlorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-yl]piperazine-1-carboxylate

Systemtic Name: methyl 4-[5-(4-chlorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-yl]piperazine-1-carboxylate Openeye Name: methyl 4-[5-(4-chlorophenyl)-4-(4-pyridyl)-1H-pyrazol-3-yl]piperazine-1-carboxylate CAS Name: 4-[5-(4-chlorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-yl]-1-piperazinecarboxylic acid methyl ester IUPAC Name: methyl 4-[5-(4-chlorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-yl]piperazine-1-carboxylate Traditional Name: 4-[5-(4-chlorophenyl)-4-(4-pyridyl)-1H-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=NNC(=C2C3=CC=NC=C3)C4=CC=C(C=C4)Cl

Isomeric SMILES

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

InChI

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