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

Systemtic Name: 3-[1-[[5-(2-methylpropyl)-1H-pyrazol-3-yl]carbonyl]piperidin-4-yl]-1-(4-phenylpiperazin-1-yl)propan-1-one Openeye Name: 3-[1-(5-isobutyl-1H-pyrazole-3-carbonyl)-4-piperidyl]-1-(4-phenylpiperazin-1-yl)propan-1-one CAS Name: 3-[1-[[5-(2-methylpropyl)-1H-pyrazol-3-yl]-oxomethyl]-4-piperidinyl]-1-(4-phenyl-1-piperazinyl)-1-propanone IUPAC Name: 3-[1-[5-(2-methylpropyl)-1H-pyrazole-3-carbonyl]piperidin-4-yl]-1-(4-phenylpiperazin-1-yl)propan-1-one Traditional Name: 3-[1-(5-isobutyl-1H-pyrazole-3-carbonyl)-4-piperidyl]-1-(4-phenylpiperazino)propan-1-one Formula: C26H37N5O2 MolecularWeight: 451.60428

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC(=NN1)C(=O)N2CCC(CC2)CCC(=O)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CC(C)CC1=CC(=NN1)C(=O)N2CCC(CC2)CCC(=O)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C26H37N5O2/c1-20(2)18-22-19-24(28-27-22)26(33)31-12-10-21(11-13-31)8-9-25(32)30-16-14-29(15-17-30)23-6-4-3-5-7-23/h3-7,19-21H,8-18H2,1-2H3,(H,27,28)