1-[4-[4-[3-(2-methylphenyl)-1-phenyl-pyrazol-4-yl]carbonylpiperazin-1-yl]phenyl]ethanone

Systemtic Name: 1-[4-[4-[3-(2-methylphenyl)-1-phenyl-pyrazol-4-yl]carbonylpiperazin-1-yl]phenyl]ethanone Openeye Name: 1-[4-[4-[3-(o-tolyl)-1-phenyl-pyrazole-4-carbonyl]piperazin-1-yl]phenyl]ethanone CAS Name: 1-[4-[4-[[3-(2-methylphenyl)-1-phenyl-4-pyrazolyl]-oxomethyl]-1-piperazinyl]phenyl]ethanone IUPAC Name: 1-[4-[4-[3-(2-methylphenyl)-1-phenylpyrazole-4-carbonyl]piperazin-1-yl]phenyl]ethanone Traditional Name: 1-[4-[4-[3-(o-tolyl)-1-phenyl-pyrazole-4-carbonyl]piperazino]phenyl]ethanone Formula: C29H28N4O2 MolecularWeight: 464.55822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NN(C=C2C(=O)N3CCN(CC3)C4=CC=C(C=C4)C(=O)C)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=CC=C1C2=NN(C=C2C(=O)N3CCN(CC3)C4=CC=C(C=C4)C(=O)C)C5=CC=CC=C5

InChI

InChI=1S/C29H28N4O2/c1-21-8-6-7-11-26(21)28-27(20-33(30-28)25-9-4-3-5-10-25)29(35)32-18-16-31(17-19-32)24-14-12-23(13-15-24)22(2)34/h3-15,20H,16-19H2,1-2H3