(1,3-diphenylpyrazol-4-yl)-[4-(phenylmethyl)piperazin-1-yl]methanone hydrochloride

Systemtic Name: (1,3-diphenylpyrazol-4-yl)-[4-(phenylmethyl)piperazin-1-yl]methanone hydrochloride Openeye Name: (4-benzylpiperazin-1-yl)-(1,3-diphenylpyrazol-4-yl)methanone hydrochloride CAS Name: (1,3-diphenyl-4-pyrazolyl)-[4-(phenylmethyl)-1-piperazinyl]methanone hydrochloride IUPAC Name: (4-benzylpiperazin-1-yl)-(1,3-diphenylpyrazol-4-yl)methanone hydrochloride Traditional Name: (4-benzylpiperazino)-(1,3-diphenylpyrazol-4-yl)methanone hydrochloride Formula: C27H27ClN4O MolecularWeight: 458.98248

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H26N4O.ClH/c32-27(30-18-16-29(17-19-30)20-22-10-4-1-5-11-22)25-21-31(24-14-8-3-9-15-24)28-26(25)23-12-6-2-7-13-23;/h1-15,21H,16-20H2;1H