2-[3,5-dimethyl-1-(2-methylpropyl)pyrazol-4-yl]-1-(4-phenylpiperazin-1-yl)ethanone

Systemtic Name: 2-[3,5-dimethyl-1-(2-methylpropyl)pyrazol-4-yl]-1-(4-phenylpiperazin-1-yl)ethanone Openeye Name: 2-(1-isobutyl-3,5-dimethyl-pyrazol-4-yl)-1-(4-phenylpiperazin-1-yl)ethanone CAS Name: 2-[3,5-dimethyl-1-(2-methylpropyl)-4-pyrazolyl]-1-(4-phenyl-1-piperazinyl)ethanone IUPAC Name: 2-[3,5-dimethyl-1-(2-methylpropyl)pyrazol-4-yl]-1-(4-phenylpiperazin-1-yl)ethanone Traditional Name: 2-(1-isobutyl-3,5-dimethyl-pyrazol-4-yl)-1-(4-phenylpiperazino)ethanone Formula: C21H30N4O MolecularWeight: 354.4891

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(C)C)C)CC(=O)N2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=NN1CC(C)C)C)CC(=O)N2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C21H30N4O/c1-16(2)15-25-18(4)20(17(3)22-25)14-21(26)24-12-10-23(11-13-24)19-8-6-5-7-9-19/h5-9,16H,10-15H2,1-4H3