1-[[5-(3-fluorophenyl)-1-benzofuran-2-yl]methyl]-4-[(2-methylsulfonylphenyl)methyl]piperazine

Systemtic Name: 1-[[5-(3-fluorophenyl)-1-benzofuran-2-yl]methyl]-4-[(2-methylsulfonylphenyl)methyl]piperazine Openeye Name: 1-[[5-(3-fluorophenyl)benzofuran-2-yl]methyl]-4-[(2-methylsulfonylphenyl)methyl]piperazine CAS Name: 1-[[5-(3-fluorophenyl)-2-benzofuranyl]methyl]-4-[(2-methylsulfonylphenyl)methyl]piperazine IUPAC Name: 1-[[5-(3-fluorophenyl)-1-benzofuran-2-yl]methyl]-4-[(2-methylsulfonylphenyl)methyl]piperazine Traditional Name: 1-[[5-(3-fluorophenyl)benzofuran-2-yl]methyl]-4-(2-mesylbenzyl)piperazine Formula: C27H27FN2O3S MolecularWeight: 478.578283

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1CN2CCN(CC2)CC3=CC4=C(O3)C=CC(=C4)C5=CC(=CC=C5)F

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1CN2CCN(CC2)CC3=CC4=C(O3)C=CC(=C4)C5=CC(=CC=C5)F

InChI

InChI=1S/C27H27FN2O3S/c1-34(31,32)27-8-3-2-5-22(27)18-29-11-13-30(14-12-29)19-25-17-23-15-21(9-10-26(23)33-25)20-6-4-7-24(28)16-20/h2-10,15-17H,11-14,18-19H2,1H3