1-[3-[1-tert-butyl-5-(4-methylphenyl)pyrazol-3-yl]propyl]-4-(4-chlorophenyl)piperazine

Systemtic Name: 1-[3-[1-tert-butyl-5-(4-methylphenyl)pyrazol-3-yl]propyl]-4-(4-chlorophenyl)piperazine Openeye Name: 1-[3-[1-tert-butyl-5-(p-tolyl)pyrazol-3-yl]propyl]-4-(4-chlorophenyl)piperazine CAS Name: 1-[3-[1-tert-butyl-5-(4-methylphenyl)-3-pyrazolyl]propyl]-4-(4-chlorophenyl)piperazine IUPAC Name: 1-[3-[1-tert-butyl-5-(4-methylphenyl)pyrazol-3-yl]propyl]-4-(4-chlorophenyl)piperazine Traditional Name: 1-[3-[1-tert-butyl-5-(p-tolyl)pyrazol-3-yl]propyl]-4-(4-chlorophenyl)piperazine Formula: C27H35ClN4 MolecularWeight: 451.0466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=NN2C(C)(C)C)CCCN3CCN(CC3)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=NN2C(C)(C)C)CCCN3CCN(CC3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C27H35ClN4/c1-21-7-9-22(10-8-21)26-20-24(29-32(26)27(2,3)4)6-5-15-30-16-18-31(19-17-30)25-13-11-23(28)12-14-25/h7-14,20H,5-6,15-19H2,1-4H3