2-(4-chlorophenyl)-5-(imidazol-1-ylmethyl)-4-[(4-phenylphenyl)methyl]-1H-pyrazol-3-one

Systemtic Name: 2-(4-chlorophenyl)-5-(imidazol-1-ylmethyl)-4-[(4-phenylphenyl)methyl]-1H-pyrazol-3-one Openeye Name: 2-(4-chlorophenyl)-5-(imidazol-1-ylmethyl)-4-[(4-phenylphenyl)methyl]-1H-pyrazol-3-one CAS Name: 2-(4-chlorophenyl)-5-(1-imidazolylmethyl)-4-[(4-phenylphenyl)methyl]-1H-pyrazol-3-one IUPAC Name: 2-(4-chlorophenyl)-5-(imidazol-1-ylmethyl)-4-[(4-phenylphenyl)methyl]-1H-pyrazol-3-one Traditional Name: 2-(4-chlorophenyl)-5-(imidazol-1-ylmethyl)-4-(4-phenylbenzyl)-3-pyrazolin-3-one Formula: C26H21ClN4O MolecularWeight: 440.92414

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)CC3=C(NN(C3=O)C4=CC=C(C=C4)Cl)CN5C=CN=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)CC3=C(NN(C3=O)C4=CC=C(C=C4)Cl)CN5C=CN=C5

InChI

InChI=1S/C26H21ClN4O/c27-22-10-12-23(13-11-22)31-26(32)24(25(29-31)17-30-15-14-28-18-30)16-19-6-8-21(9-7-19)20-4-2-1-3-5-20/h1-15,18,29H,16-17H2