[1-(6-methoxypyridin-3-yl)-5-phenyl-pyrazol-3-yl]-[4-(phenylmethyl)piperazin-1-yl]methanone

Systemtic Name: [1-(6-methoxypyridin-3-yl)-5-phenyl-pyrazol-3-yl]-[4-(phenylmethyl)piperazin-1-yl]methanone Openeye Name: (4-benzylpiperazin-1-yl)-[1-(6-methoxy-3-pyridyl)-5-phenyl-pyrazol-3-yl]methanone CAS Name: [1-(6-methoxy-3-pyridinyl)-5-phenyl-3-pyrazolyl]-[4-(phenylmethyl)-1-piperazinyl]methanone IUPAC Name: (4-benzylpiperazin-1-yl)-[1-(6-methoxypyridin-3-yl)-5-phenylpyrazol-3-yl]methanone Traditional Name: (4-benzylpiperazino)-[1-(6-methoxy-3-pyridyl)-5-phenyl-pyrazol-3-yl]methanone Formula: C27H27N5O2 MolecularWeight: 453.53558

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=C(C=C1)N2C(=CC(=N2)C(=O)N3CCN(CC3)CC4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

COC1=NC=C(C=C1)N2C(=CC(=N2)C(=O)N3CCN(CC3)CC4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H27N5O2/c1-34-26-13-12-23(19-28-26)32-25(22-10-6-3-7-11-22)18-24(29-32)27(33)31-16-14-30(15-17-31)20-21-8-4-2-5-9-21/h2-13,18-19H,14-17,20H2,1H3