1-(3,4-dimethoxyphenyl)-5-methyl-2-[3-[4-(4-methylpyridin-2-yl)piperazin-1-yl]propyl]pyrazol-3-one

Systemtic Name: 1-(3,4-dimethoxyphenyl)-5-methyl-2-[3-[4-(4-methylpyridin-2-yl)piperazin-1-yl]propyl]pyrazol-3-one Openeye Name: 1-(3,4-dimethoxyphenyl)-5-methyl-2-[3-[4-(4-methyl-2-pyridyl)piperazin-1-yl]propyl]pyrazol-3-one CAS Name: 1-(3,4-dimethoxyphenyl)-5-methyl-2-[3-[4-(4-methyl-2-pyridinyl)-1-piperazinyl]propyl]-3-pyrazolone IUPAC Name: 1-(3,4-dimethoxyphenyl)-5-methyl-2-[3-[4-(4-methylpyridin-2-yl)piperazin-1-yl]propyl]pyrazol-3-one Traditional Name: 1-(3,4-dimethoxyphenyl)-5-methyl-2-[3-[4-(4-methyl-2-pyridyl)piperazino]propyl]-3-pyrazolin-3-one Formula: C25H33N5O3 MolecularWeight: 451.56122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC=C1)N2CCN(CC2)CCCN3C(=O)C=C(N3C4=CC(=C(C=C4)OC)OC)C

Isomeric SMILES

CC1=CC(=NC=C1)N2CCN(CC2)CCCN3C(=O)C=C(N3C4=CC(=C(C=C4)OC)OC)C

InChI

InChI=1S/C25H33N5O3/c1-19-8-9-26-24(16-19)28-14-12-27(13-15-28)10-5-11-29-25(31)17-20(2)30(29)21-6-7-22(32-3)23(18-21)33-4/h6-9,16-18H,5,10-15H2,1-4H3