5-methyl-2-[4-[4-(4-methylpyridin-2-yl)piperazin-1-yl]butyl]-1-phenyl-pyrazol-3-one trihydrochloride

Systemtic Name: 5-methyl-2-[4-[4-(4-methylpyridin-2-yl)piperazin-1-yl]butyl]-1-phenyl-pyrazol-3-one trihydrochloride Openeye Name: 5-methyl-2-[4-[4-(4-methyl-2-pyridyl)piperazin-1-yl]butyl]-1-phenyl-pyrazol-3-one trihydrochloride CAS Name: 5-methyl-2-[4-[4-(4-methyl-2-pyridinyl)-1-piperazinyl]butyl]-1-phenyl-3-pyrazolone trihydrochloride IUPAC Name: 5-methyl-2-[4-[4-(4-methylpyridin-2-yl)piperazin-1-yl]butyl]-1-phenylpyrazol-3-one trihydrochloride Traditional Name: 5-methyl-2-[4-[4-(4-methyl-2-pyridyl)piperazino]butyl]-1-phenyl-3-pyrazolin-3-one trihydrochloride Formula: C24H34Cl3N5O MolecularWeight: 514.91866

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC=C1)N2CCN(CC2)CCCCN3C(=O)C=C(N3C4=CC=CC=C4)C.Cl.Cl.Cl

Isomeric SMILES

CC1=CC(=NC=C1)N2CCN(CC2)CCCCN3C(=O)C=C(N3C4=CC=CC=C4)C.Cl.Cl.Cl

InChI

InChI=1S/C24H31N5O.3ClH/c1-20-10-11-25-23(18-20)27-16-14-26(15-17-27)12-6-7-13-28-24(30)19-21(2)29(28)22-8-4-3-5-9-22;;;/h3-5,8-11,18-19H,6-7,12-17H2,1-2H3;3*1H