N-[[1-tert-butyl-5-(4-methylphenyl)pyrazol-3-yl]methyl]-2-(4-phenylpiperazin-1-yl)ethanamine

Systemtic Name: N-[[1-tert-butyl-5-(4-methylphenyl)pyrazol-3-yl]methyl]-2-(4-phenylpiperazin-1-yl)ethanamine Openeye Name: N-[[1-tert-butyl-5-(p-tolyl)pyrazol-3-yl]methyl]-2-(4-phenylpiperazin-1-yl)ethanamine CAS Name: N-[[1-tert-butyl-5-(4-methylphenyl)-3-pyrazolyl]methyl]-2-(4-phenyl-1-piperazinyl)ethanamine IUPAC Name: N-[[1-tert-butyl-5-(4-methylphenyl)pyrazol-3-yl]methyl]-2-(4-phenylpiperazin-1-yl)ethanamine Traditional Name: [1-tert-butyl-5-(p-tolyl)pyrazol-3-yl]methyl-[2-(4-phenylpiperazino)ethyl]amine Formula: C27H37N5 MolecularWeight: 431.61618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=NN2C(C)(C)C)CNCCN3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=NN2C(C)(C)C)CNCCN3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C27H37N5/c1-22-10-12-23(13-11-22)26-20-24(29-32(26)27(2,3)4)21-28-14-15-30-16-18-31(19-17-30)25-8-6-5-7-9-25/h5-13,20,28H,14-19,21H2,1-4H3