1-[5-(4-chlorophenyl)-1-(phenylmethyl)-4-pyridin-4-yl-pyrazol-3-yl]piperidin-2-one

Systemtic Name: 1-[5-(4-chlorophenyl)-1-(phenylmethyl)-4-pyridin-4-yl-pyrazol-3-yl]piperidin-2-one Openeye Name: 1-[1-benzyl-5-(4-chlorophenyl)-4-(4-pyridyl)pyrazol-3-yl]piperidin-2-one CAS Name: 1-[5-(4-chlorophenyl)-1-(phenylmethyl)-4-pyridin-4-yl-3-pyrazolyl]-2-piperidinone IUPAC Name: 1-[1-benzyl-5-(4-chlorophenyl)-4-pyridin-4-ylpyrazol-3-yl]piperidin-2-one Traditional Name: 1-[1-benzyl-5-(4-chlorophenyl)-4-(4-pyridyl)pyrazol-3-yl]-2-piperidone Formula: C26H23ClN4O MolecularWeight: 442.94002

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(=O)C1)C2=NN(C(=C2C3=CC=NC=C3)C4=CC=C(C=C4)Cl)CC5=CC=CC=C5

Isomeric SMILES

C1CCN(C(=O)C1)C2=NN(C(=C2C3=CC=NC=C3)C4=CC=C(C=C4)Cl)CC5=CC=CC=C5

InChI

InChI=1S/C26H23ClN4O/c27-22-11-9-21(10-12-22)25-24(20-13-15-28-16-14-20)26(30-17-5-4-8-23(30)32)29-31(25)18-19-6-2-1-3-7-19/h1-3,6-7,9-16H,4-5,8,17-18H2