[1-(4-fluorophenyl)-5-pyrrol-1-yl-pyrazol-4-yl]-[4-(phenylmethyl)piperazin-1-yl]methanone

Systemtic Name: [1-(4-fluorophenyl)-5-pyrrol-1-yl-pyrazol-4-yl]-[4-(phenylmethyl)piperazin-1-yl]methanone Openeye Name: (4-benzylpiperazin-1-yl)-[1-(4-fluorophenyl)-5-pyrrol-1-yl-pyrazol-4-yl]methanone CAS Name: [1-(4-fluorophenyl)-5-(1-pyrrolyl)-4-pyrazolyl]-[4-(phenylmethyl)-1-piperazinyl]methanone IUPAC Name: (4-benzylpiperazin-1-yl)-[1-(4-fluorophenyl)-5-pyrrol-1-ylpyrazol-4-yl]methanone Traditional Name: (4-benzylpiperazino)-[1-(4-fluorophenyl)-5-pyrrol-1-yl-pyrazol-4-yl]methanone Formula: C25H24FN5O MolecularWeight: 429.489363

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C(=O)C3=C(N(N=C3)C4=CC=C(C=C4)F)N5C=CC=C5

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C(=O)C3=C(N(N=C3)C4=CC=C(C=C4)F)N5C=CC=C5

InChI

InChI=1S/C25H24FN5O/c26-21-8-10-22(11-9-21)31-24(29-12-4-5-13-29)23(18-27-31)25(32)30-16-14-28(15-17-30)19-20-6-2-1-3-7-20/h1-13,18H,14-17,19H2