[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-(1,3-diphenylpyrazol-4-yl)methanone

Systemtic Name: [4-[(4-chlorophenyl)methyl]piperazin-1-yl]-(1,3-diphenylpyrazol-4-yl)methanone Openeye Name: [4-[(4-chlorophenyl)methyl]piperazin-1-yl]-(1,3-diphenylpyrazol-4-yl)methanone CAS Name: [4-[(4-chlorophenyl)methyl]-1-piperazinyl]-(1,3-diphenyl-4-pyrazolyl)methanone IUPAC Name: [4-[(4-chlorophenyl)methyl]piperazin-1-yl]-(1,3-diphenylpyrazol-4-yl)methanone Traditional Name: [4-(4-chlorobenzyl)piperazino]-(1,3-diphenylpyrazol-4-yl)methanone Formula: C27H25ClN4O MolecularWeight: 456.9666

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)Cl)C(=O)C3=CN(N=C3C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)Cl)C(=O)C3=CN(N=C3C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H25ClN4O/c28-23-13-11-21(12-14-23)19-30-15-17-31(18-16-30)27(33)25-20-32(24-9-5-2-6-10-24)29-26(25)22-7-3-1-4-8-22/h1-14,20H,15-19H2