[2-(2,4-dimethylphenyl)-5-thiophen-2-yl-pyrazol-3-yl]-[4-(2-ethoxyphenyl)piperazin-1-yl]methanone

Systemtic Name: [2-(2,4-dimethylphenyl)-5-thiophen-2-yl-pyrazol-3-yl]-[4-(2-ethoxyphenyl)piperazin-1-yl]methanone Openeye Name: [2-(2,4-dimethylphenyl)-5-(2-thienyl)pyrazol-3-yl]-[4-(2-ethoxyphenyl)piperazin-1-yl]methanone CAS Name: [2-(2,4-dimethylphenyl)-5-thiophen-2-yl-3-pyrazolyl]-[4-(2-ethoxyphenyl)-1-piperazinyl]methanone IUPAC Name: [2-(2,4-dimethylphenyl)-5-thiophen-2-ylpyrazol-3-yl]-[4-(2-ethoxyphenyl)piperazin-1-yl]methanone Traditional Name: [2-(2,4-dimethylphenyl)-5-(2-thienyl)pyrazol-3-yl]-(4-o-phenetylpiperazino)methanone Formula: C28H30N4O2S MolecularWeight: 486.6284

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2CCN(CC2)C(=O)C3=CC(=NN3C4=C(C=C(C=C4)C)C)C5=CC=CS5

Isomeric SMILES

CCOC1=CC=CC=C1N2CCN(CC2)C(=O)C3=CC(=NN3C4=C(C=C(C=C4)C)C)C5=CC=CS5

InChI

InChI=1S/C28H30N4O2S/c1-4-34-26-9-6-5-8-24(26)30-13-15-31(16-14-30)28(33)25-19-22(27-10-7-17-35-27)29-32(25)23-12-11-20(2)18-21(23)3/h5-12,17-19H,4,13-16H2,1-3H3