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

Systemtic Name: 1-[[5-(3-fluorophenyl)-1-benzofuran-2-yl]methyl]-4-thiophen-2-ylsulfonyl-piperazine Openeye Name: 1-[[5-(3-fluorophenyl)benzofuran-2-yl]methyl]-4-(2-thienylsulfonyl)piperazine CAS Name: 1-[[5-(3-fluorophenyl)-2-benzofuranyl]methyl]-4-thiophen-2-ylsulfonylpiperazine IUPAC Name: 1-[[5-(3-fluorophenyl)-1-benzofuran-2-yl]methyl]-4-thiophen-2-ylsulfonylpiperazine Traditional Name: 1-[[5-(3-fluorophenyl)benzofuran-2-yl]methyl]-4-(2-thienylsulfonyl)piperazine Formula: C23H21FN2O3S2 MolecularWeight: 456.552843

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(O2)C=CC(=C3)C4=CC(=CC=C4)F)S(=O)(=O)C5=CC=CS5

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(O2)C=CC(=C3)C4=CC(=CC=C4)F)S(=O)(=O)C5=CC=CS5

InChI

InChI=1S/C23H21FN2O3S2/c24-20-4-1-3-17(14-20)18-6-7-22-19(13-18)15-21(29-22)16-25-8-10-26(11-9-25)31(27,28)23-5-2-12-30-23/h1-7,12-15H,8-11,16H2