2-[3-[4-(4-methylpyridin-2-yl)piperazin-1-yl]propyl]-1-phenyl-5-propyl-pyrazol-3-one hydrochloride

Systemtic Name: 2-[3-[4-(4-methylpyridin-2-yl)piperazin-1-yl]propyl]-1-phenyl-5-propyl-pyrazol-3-one hydrochloride Openeye Name: 2-[3-[4-(4-methyl-2-pyridyl)piperazin-1-yl]propyl]-1-phenyl-5-propyl-pyrazol-3-one hydrochloride CAS Name: 2-[3-[4-(4-methyl-2-pyridinyl)-1-piperazinyl]propyl]-1-phenyl-5-propyl-3-pyrazolone hydrochloride IUPAC Name: 2-[3-[4-(4-methylpyridin-2-yl)piperazin-1-yl]propyl]-1-phenyl-5-propylpyrazol-3-one hydrochloride Traditional Name: 2-[3-[4-(4-methyl-2-pyridyl)piperazino]propyl]-1-phenyl-5-propyl-3-pyrazolin-3-one hydrochloride Formula: C25H34ClN5O MolecularWeight: 456.02336

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N(N1C2=CC=CC=C2)CCCN3CCN(CC3)C4=NC=CC(=C4)C.Cl

Isomeric SMILES

CCCC1=CC(=O)N(N1C2=CC=CC=C2)CCCN3CCN(CC3)C4=NC=CC(=C4)C.Cl

InChI

InChI=1S/C25H33N5O.ClH/c1-3-8-23-20-25(31)29(30(23)22-9-5-4-6-10-22)14-7-13-27-15-17-28(18-16-27)24-19-21(2)11-12-26-24;/h4-6,9-12,19-20H,3,7-8,13-18H2,1-2H3;1H