[4-[3-(2,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]carbonylpiperazin-1-yl]-phenyl-methanone

Systemtic Name: [4-[3-(2,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]carbonylpiperazin-1-yl]-phenyl-methanone Openeye Name: [4-[3-(2,4-dimethoxyphenyl)-1-phenyl-pyrazole-4-carbonyl]piperazin-1-yl]-phenyl-methanone CAS Name: [4-[[3-(2,4-dimethoxyphenyl)-1-phenyl-4-pyrazolyl]-oxomethyl]-1-piperazinyl]-phenylmethanone IUPAC Name: [4-[3-(2,4-dimethoxyphenyl)-1-phenylpyrazole-4-carbonyl]piperazin-1-yl]-phenylmethanone Traditional Name: [4-[3-(2,4-dimethoxyphenyl)-1-phenyl-pyrazole-4-carbonyl]piperazino]-phenyl-methanone Formula: C29H28N4O4 MolecularWeight: 496.55702

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H28N4O4/c1-36-23-13-14-24(26(19-23)37-2)27-25(20-33(30-27)22-11-7-4-8-12-22)29(35)32-17-15-31(16-18-32)28(34)21-9-5-3-6-10-21/h3-14,19-20H,15-18H2,1-2H3