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

Systemtic Name: [4-[(3-chlorophenyl)methyl]piperazin-1-yl]-(1,3-diphenylpyrazol-4-yl)methanone Openeye Name: [4-[(3-chlorophenyl)methyl]piperazin-1-yl]-(1,3-diphenylpyrazol-4-yl)methanone CAS Name: [4-[(3-chlorophenyl)methyl]-1-piperazinyl]-(1,3-diphenyl-4-pyrazolyl)methanone IUPAC Name: [4-[(3-chlorophenyl)methyl]piperazin-1-yl]-(1,3-diphenylpyrazol-4-yl)methanone Traditional Name: [4-(3-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(=CC=C2)Cl)C(=O)C3=CN(N=C3C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

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

InChI

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