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

Systemtic Name: 4-[(3-chlorophenyl)methyl]-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)piperazin-2-one Openeye Name: 4-[(3-chlorophenyl)methyl]-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)piperazin-2-one CAS Name: 4-[(3-chlorophenyl)methyl]-3-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-2-piperazinone IUPAC Name: 4-[(3-chlorophenyl)methyl]-3-(3,5-dimethyl-1-phenylpyrazol-4-yl)piperazin-2-one Traditional Name: 4-(3-chlorobenzyl)-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)piperazin-2-one Formula: C22H23ClN4O MolecularWeight: 394.89722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C3C(=O)NCCN3CC4=CC(=CC=C4)Cl

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)C3C(=O)NCCN3CC4=CC(=CC=C4)Cl

InChI

InChI=1S/C22H23ClN4O/c1-15-20(16(2)27(25-15)19-9-4-3-5-10-19)21-22(28)24-11-12-26(21)14-17-7-6-8-18(23)13-17/h3-10,13,21H,11-12,14H2,1-2H3,(H,24,28)