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

Systemtic Name: 4-[3-(4-chlorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]-1-ethanoyl-piperidin-2-one Openeye Name: 1-acetyl-4-[3-(4-chlorophenyl)-4-(4-pyridyl)-1H-pyrazol-5-yl]piperidin-2-one CAS Name: 1-acetyl-4-[3-(4-chlorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]-2-piperidinone IUPAC Name: 1-acetyl-4-[3-(4-chlorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]piperidin-2-one Traditional Name: 1-acetyl-4-[3-(4-chlorophenyl)-4-(4-pyridyl)-1H-pyrazol-5-yl]-2-piperidone Formula: C21H19ClN4O2 MolecularWeight: 394.85416

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC(CC1=O)C2=C(C(=NN2)C3=CC=C(C=C3)Cl)C4=CC=NC=C4

Isomeric SMILES

CC(=O)N1CCC(CC1=O)C2=C(C(=NN2)C3=CC=C(C=C3)Cl)C4=CC=NC=C4

InChI

InChI=1S/C21H19ClN4O2/c1-13(27)26-11-8-16(12-18(26)28)21-19(14-6-9-23-10-7-14)20(24-25-21)15-2-4-17(22)5-3-15/h2-7,9-10,16H,8,11-12H2,1H3,(H,24,25)