N-[[5-(2-methylpropyl)-1-phenyl-pyrazol-3-yl]methyl]-2-(4-phenylpiperazin-1-yl)ethanamine

Systemtic Name: N-[[5-(2-methylpropyl)-1-phenyl-pyrazol-3-yl]methyl]-2-(4-phenylpiperazin-1-yl)ethanamine Openeye Name: N-[(5-isobutyl-1-phenyl-pyrazol-3-yl)methyl]-2-(4-phenylpiperazin-1-yl)ethanamine CAS Name: N-[[5-(2-methylpropyl)-1-phenyl-3-pyrazolyl]methyl]-2-(4-phenyl-1-piperazinyl)ethanamine IUPAC Name: N-[[5-(2-methylpropyl)-1-phenylpyrazol-3-yl]methyl]-2-(4-phenylpiperazin-1-yl)ethanamine Traditional Name: (5-isobutyl-1-phenyl-pyrazol-3-yl)methyl-[2-(4-phenylpiperazino)ethyl]amine Formula: C26H35N5 MolecularWeight: 417.5896

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC(=NN1C2=CC=CC=C2)CNCCN3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CC(C)CC1=CC(=NN1C2=CC=CC=C2)CNCCN3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C26H35N5/c1-22(2)19-26-20-23(28-31(26)25-11-7-4-8-12-25)21-27-13-14-29-15-17-30(18-16-29)24-9-5-3-6-10-24/h3-12,20,22,27H,13-19,21H2,1-2H3