1-[3-[1-tert-butyl-5-(4-methylphenyl)pyrazol-3-yl]propyl]-4-(2,3-dimethylphenyl)piperazine

Systemtic Name: 1-[3-[1-tert-butyl-5-(4-methylphenyl)pyrazol-3-yl]propyl]-4-(2,3-dimethylphenyl)piperazine Openeye Name: 1-[3-[1-tert-butyl-5-(p-tolyl)pyrazol-3-yl]propyl]-4-(2,3-dimethylphenyl)piperazine CAS Name: 1-[3-[1-tert-butyl-5-(4-methylphenyl)-3-pyrazolyl]propyl]-4-(2,3-dimethylphenyl)piperazine IUPAC Name: 1-[3-[1-tert-butyl-5-(4-methylphenyl)pyrazol-3-yl]propyl]-4-(2,3-dimethylphenyl)piperazine Traditional Name: 1-[3-[1-tert-butyl-5-(p-tolyl)pyrazol-3-yl]propyl]-4-(2,3-dimethylphenyl)piperazine Formula: C29H40N4 MolecularWeight: 444.6547

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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=CC(=C4C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=NN2C(C)(C)C)CCCN3CCN(CC3)C4=CC=CC(=C4C)C

InChI

InChI=1S/C29H40N4/c1-22-12-14-25(15-13-22)28-21-26(30-33(28)29(4,5)6)10-8-16-31-17-19-32(20-18-31)27-11-7-9-23(2)24(27)3/h7,9,11-15,21H,8,10,16-20H2,1-6H3