[3-(4-methoxyphenyl)-1-(phenylmethyl)pyrazol-4-yl]-(4-phenylpiperazin-1-yl)methanone

Systemtic Name: [3-(4-methoxyphenyl)-1-(phenylmethyl)pyrazol-4-yl]-(4-phenylpiperazin-1-yl)methanone Openeye Name: [1-benzyl-3-(4-methoxyphenyl)pyrazol-4-yl]-(4-phenylpiperazin-1-yl)methanone CAS Name: [3-(4-methoxyphenyl)-1-(phenylmethyl)-4-pyrazolyl]-(4-phenyl-1-piperazinyl)methanone IUPAC Name: [1-benzyl-3-(4-methoxyphenyl)pyrazol-4-yl]-(4-phenylpiperazin-1-yl)methanone Traditional Name: [1-benzyl-3-(4-methoxyphenyl)pyrazol-4-yl]-(4-phenylpiperazino)methanone Formula: C28H28N4O2 MolecularWeight: 452.54752

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN(C=C2C(=O)N3CCN(CC3)C4=CC=CC=C4)CC5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN(C=C2C(=O)N3CCN(CC3)C4=CC=CC=C4)CC5=CC=CC=C5

InChI

InChI=1S/C28H28N4O2/c1-34-25-14-12-23(13-15-25)27-26(21-32(29-27)20-22-8-4-2-5-9-22)28(33)31-18-16-30(17-19-31)24-10-6-3-7-11-24/h2-15,21H,16-20H2,1H3