[2-(2-chlorophenyl)-5-(3,4-dimethylphenyl)pyrazol-3-yl]-[4-(phenylmethyl)piperazin-1-yl]methanone

Systemtic Name: [2-(2-chlorophenyl)-5-(3,4-dimethylphenyl)pyrazol-3-yl]-[4-(phenylmethyl)piperazin-1-yl]methanone Openeye Name: (4-benzylpiperazin-1-yl)-[2-(2-chlorophenyl)-5-(3,4-dimethylphenyl)pyrazol-3-yl]methanone CAS Name: [2-(2-chlorophenyl)-5-(3,4-dimethylphenyl)-3-pyrazolyl]-[4-(phenylmethyl)-1-piperazinyl]methanone IUPAC Name: (4-benzylpiperazin-1-yl)-[2-(2-chlorophenyl)-5-(3,4-dimethylphenyl)pyrazol-3-yl]methanone Traditional Name: (4-benzylpiperazino)-[2-(2-chlorophenyl)-5-(3,4-dimethylphenyl)pyrazol-3-yl]methanone Formula: C29H29ClN4O MolecularWeight: 485.01976

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN(C(=C2)C(=O)N3CCN(CC3)CC4=CC=CC=C4)C5=CC=CC=C5Cl)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN(C(=C2)C(=O)N3CCN(CC3)CC4=CC=CC=C4)C5=CC=CC=C5Cl)C

InChI

InChI=1S/C29H29ClN4O/c1-21-12-13-24(18-22(21)2)26-19-28(34(31-26)27-11-7-6-10-25(27)30)29(35)33-16-14-32(15-17-33)20-23-8-4-3-5-9-23/h3-13,18-19H,14-17,20H2,1-2H3