4-[[4-(4-chlorophenyl)piperazin-1-yl]methyl]-1,5-dimethyl-2-phenyl-pyrazol-3-one

Systemtic Name: 4-[[4-(4-chlorophenyl)piperazin-1-yl]methyl]-1,5-dimethyl-2-phenyl-pyrazol-3-one Openeye Name: 4-[[4-(4-chlorophenyl)piperazin-1-yl]methyl]-1,5-dimethyl-2-phenyl-pyrazol-3-one CAS Name: 4-[[4-(4-chlorophenyl)-1-piperazinyl]methyl]-1,5-dimethyl-2-phenyl-3-pyrazolone IUPAC Name: 4-[[4-(4-chlorophenyl)piperazin-1-yl]methyl]-1,5-dimethyl-2-phenylpyrazol-3-one Traditional Name: 4-[[4-(4-chlorophenyl)piperazino]methyl]-1,5-dimethyl-2-phenyl-3-pyrazolin-3-one Formula: C22H25ClN4O MolecularWeight: 396.9131

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)CN3CCN(CC3)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)CN3CCN(CC3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H25ClN4O/c1-17-21(22(28)27(24(17)2)20-6-4-3-5-7-20)16-25-12-14-26(15-13-25)19-10-8-18(23)9-11-19/h3-11H,12-16H2,1-2H3