[3-(4-bromophenyl)-1-phenyl-pyrazol-4-yl]-(4-phenylpiperazin-1-yl)methanone hydrochloride

Systemtic Name: [3-(4-bromophenyl)-1-phenyl-pyrazol-4-yl]-(4-phenylpiperazin-1-yl)methanone hydrochloride Openeye Name: [3-(4-bromophenyl)-1-phenyl-pyrazol-4-yl]-(4-phenylpiperazin-1-yl)methanone hydrochloride CAS Name: [3-(4-bromophenyl)-1-phenyl-4-pyrazolyl]-(4-phenyl-1-piperazinyl)methanone hydrochloride IUPAC Name: [3-(4-bromophenyl)-1-phenylpyrazol-4-yl]-(4-phenylpiperazin-1-yl)methanone hydrochloride Traditional Name: [3-(4-bromophenyl)-1-phenyl-pyrazol-4-yl]-(4-phenylpiperazino)methanone hydrochloride Formula: C26H24BrClN4O MolecularWeight: 523.85196

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=O)C3=CN(N=C3C4=CC=C(C=C4)Br)C5=CC=CC=C5.Cl

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=O)C3=CN(N=C3C4=CC=C(C=C4)Br)C5=CC=CC=C5.Cl

InChI

InChI=1S/C26H23BrN4O.ClH/c27-21-13-11-20(12-14-21)25-24(19-31(28-25)23-9-5-2-6-10-23)26(32)30-17-15-29(16-18-30)22-7-3-1-4-8-22;/h1-14,19H,15-18H2;1H