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

Systemtic Name: 2-[4-(3-chlorophenyl)piperazin-1-yl]-N-[[5-(2-methylpropyl)-1-phenyl-pyrazol-3-yl]methyl]ethanamine Openeye Name: 2-[4-(3-chlorophenyl)piperazin-1-yl]-N-[(5-isobutyl-1-phenyl-pyrazol-3-yl)methyl]ethanamine CAS Name: 2-[4-(3-chlorophenyl)-1-piperazinyl]-N-[[5-(2-methylpropyl)-1-phenyl-3-pyrazolyl]methyl]ethanamine IUPAC Name: 2-[4-(3-chlorophenyl)piperazin-1-yl]-N-[[5-(2-methylpropyl)-1-phenylpyrazol-3-yl]methyl]ethanamine Traditional Name: 2-[4-(3-chlorophenyl)piperazino]ethyl-[(5-isobutyl-1-phenyl-pyrazol-3-yl)methyl]amine Formula: C26H34ClN5 MolecularWeight: 452.03466

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H34ClN5/c1-21(2)17-26-19-23(29-32(26)24-8-4-3-5-9-24)20-28-11-12-30-13-15-31(16-14-30)25-10-6-7-22(27)18-25/h3-10,18-19,21,28H,11-17,20H2,1-2H3