3-[1-[[3-(2-methylpropyl)-1H-pyrazol-5-yl]methyl]piperidin-4-yl]-1-(4-phenylpiperazin-1-yl)propan-1-one

Systemtic Name: 3-[1-[[3-(2-methylpropyl)-1H-pyrazol-5-yl]methyl]piperidin-4-yl]-1-(4-phenylpiperazin-1-yl)propan-1-one Openeye Name: 3-[1-[(3-isobutyl-1H-pyrazol-5-yl)methyl]-4-piperidyl]-1-(4-phenylpiperazin-1-yl)propan-1-one CAS Name: 3-[1-[[3-(2-methylpropyl)-1H-pyrazol-5-yl]methyl]-4-piperidinyl]-1-(4-phenyl-1-piperazinyl)-1-propanone IUPAC Name: 3-[1-[[3-(2-methylpropyl)-1H-pyrazol-5-yl]methyl]piperidin-4-yl]-1-(4-phenylpiperazin-1-yl)propan-1-one Traditional Name: 3-[1-[(3-isobutyl-1H-pyrazol-5-yl)methyl]-4-piperidyl]-1-(4-phenylpiperazino)propan-1-one Formula: C26H39N5O MolecularWeight: 437.62076

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=NNC(=C1)CN2CCC(CC2)CCC(=O)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CC(C)CC1=NNC(=C1)CN2CCC(CC2)CCC(=O)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C26H39N5O/c1-21(2)18-23-19-24(28-27-23)20-29-12-10-22(11-13-29)8-9-26(32)31-16-14-30(15-17-31)25-6-4-3-5-7-25/h3-7,19,21-22H,8-18,20H2,1-2H3,(H,27,28)