N-[(4-fluorophenyl)methyl]-4-piperidin-1-ylsulfonyl-N-[(3,4,5-trimethoxyphenyl)methyl]benzenesulfonamide

Systemtic Name: N-[(4-fluorophenyl)methyl]-4-piperidin-1-ylsulfonyl-N-[(3,4,5-trimethoxyphenyl)methyl]benzenesulfonamide Openeye Name: N-[(4-fluorophenyl)methyl]-4-(1-piperidylsulfonyl)-N-[(3,4,5-trimethoxyphenyl)methyl]benzenesulfonamide CAS Name: N-[(4-fluorophenyl)methyl]-4-(1-piperidinylsulfonyl)-N-[(3,4,5-trimethoxyphenyl)methyl]benzenesulfonamide IUPAC Name: N-[(4-fluorophenyl)methyl]-4-piperidin-1-ylsulfonyl-N-[(3,4,5-trimethoxyphenyl)methyl]benzenesulfonamide Traditional Name: N-(4-fluorobenzyl)-4-piperidinosulfonyl-N-(3,4,5-trimethoxybenzyl)benzenesulfonamide Formula: C28H33FN2O7S2 MolecularWeight: 592.699223

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CN(CC2=CC=C(C=C2)F)S(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CN(CC2=CC=C(C=C2)F)S(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C28H33FN2O7S2/c1-36-26-17-22(18-27(37-2)28(26)38-3)20-31(19-21-7-9-23(29)10-8-21)40(34,35)25-13-11-24(12-14-25)39(32,33)30-15-5-4-6-16-30/h7-14,17-18H,4-6,15-16,19-20H2,1-3H3