1-[[5-(2-methoxyphenyl)-1-benzofuran-2-yl]methyl]-4-methylsulfonyl-piperazine

Systemtic Name: 1-[[5-(2-methoxyphenyl)-1-benzofuran-2-yl]methyl]-4-methylsulfonyl-piperazine Openeye Name: 1-[[5-(2-methoxyphenyl)benzofuran-2-yl]methyl]-4-methylsulfonyl-piperazine CAS Name: 1-[[5-(2-methoxyphenyl)-2-benzofuranyl]methyl]-4-methylsulfonylpiperazine IUPAC Name: 1-[[5-(2-methoxyphenyl)-1-benzofuran-2-yl]methyl]-4-methylsulfonylpiperazine Traditional Name: 1-mesyl-4-[[5-(2-methoxyphenyl)benzofuran-2-yl]methyl]piperazine Formula: C21H24N2O4S MolecularWeight: 400.49126

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=CC3=C(C=C2)OC(=C3)CN4CCN(CC4)S(=O)(=O)C

Isomeric SMILES

COC1=CC=CC=C1C2=CC3=C(C=C2)OC(=C3)CN4CCN(CC4)S(=O)(=O)C

InChI

InChI=1S/C21H24N2O4S/c1-26-21-6-4-3-5-19(21)16-7-8-20-17(13-16)14-18(27-20)15-22-9-11-23(12-10-22)28(2,24)25/h3-8,13-14H,9-12,15H2,1-2H3