4-(4-chlorophenyl)-2-(piperidin-4-ylmethyl)-3-pyridin-4-yl-1H-pyrazol-5-one

Systemtic Name: 4-(4-chlorophenyl)-2-(piperidin-4-ylmethyl)-3-pyridin-4-yl-1H-pyrazol-5-one Openeye Name: 4-(4-chlorophenyl)-2-(4-piperidylmethyl)-3-(4-pyridyl)-1H-pyrazol-5-one CAS Name: 4-(4-chlorophenyl)-2-(4-piperidinylmethyl)-3-pyridin-4-yl-1H-pyrazol-5-one IUPAC Name: 4-(4-chlorophenyl)-2-(piperidin-4-ylmethyl)-3-pyridin-4-yl-1H-pyrazol-5-one Traditional Name: 4-(4-chlorophenyl)-1-(4-piperidylmethyl)-5-(4-pyridyl)-3-pyrazolin-3-one Formula: C20H21ClN4O MolecularWeight: 368.85994

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1CN2C(=C(C(=O)N2)C3=CC=C(C=C3)Cl)C4=CC=NC=C4

Isomeric SMILES

C1CNCCC1CN2C(=C(C(=O)N2)C3=CC=C(C=C3)Cl)C4=CC=NC=C4

InChI

InChI=1S/C20H21ClN4O/c21-17-3-1-15(2-4-17)18-19(16-7-11-23-12-8-16)25(24-20(18)26)13-14-5-9-22-10-6-14/h1-4,7-8,11-12,14,22H,5-6,9-10,13H2,(H,24,26)