N-[[4-[(3S)-4,4-dimethyl-3,5-diphenyl-3H-pyrazol-2-yl]phenyl]methyl]-2-methyl-aniline

Systemtic Name: N-[[4-[(3S)-4,4-dimethyl-3,5-diphenyl-3H-pyrazol-2-yl]phenyl]methyl]-2-methyl-aniline Openeye Name: N-[[4-[(3S)-4,4-dimethyl-3,5-diphenyl-3H-pyrazol-2-yl]phenyl]methyl]-2-methyl-aniline CAS Name: N-[[4-[(3S)-4,4-dimethyl-3,5-diphenyl-3H-pyrazol-2-yl]phenyl]methyl]-2-methylaniline IUPAC Name: N-[[4-[(3S)-4,4-dimethyl-3,5-diphenyl-3H-pyrazol-2-yl]phenyl]methyl]-2-methylaniline Traditional Name: [4-[(5S)-4,4-dimethyl-3,5-diphenyl-2-pyrazolin-1-yl]benzyl]-(o-tolyl)amine Formula: C31H31N3 MolecularWeight: 445.59794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NCC2=CC=C(C=C2)N3C(C(C(=N3)C4=CC=CC=C4)(C)C)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=CC=C1NCC2=CC=C(C=C2)N3[C@H](C(C(=N3)C4=CC=CC=C4)(C)C)C5=CC=CC=C5

InChI

InChI=1S/C31H31N3/c1-23-12-10-11-17-28(23)32-22-24-18-20-27(21-19-24)34-30(26-15-8-5-9-16-26)31(2,3)29(33-34)25-13-6-4-7-14-25/h4-21,30,32H,22H2,1-3H3/t30-/m0/s1