3-[5-[[(4-fluorophenyl)methylamino]methyl]-2-methoxy-phenyl]-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide

Systemtic Name: 3-[5-[[(4-fluorophenyl)methylamino]methyl]-2-methoxy-phenyl]-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide Openeye Name: 3-[5-[[(4-fluorophenyl)methylamino]methyl]-2-methoxy-phenyl]-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide CAS Name: 3-[5-[[(4-fluorophenyl)methylamino]methyl]-2-methoxyphenyl]-N-[2-(1-pyrrolidinyl)ethyl]benzenesulfonamide IUPAC Name: 3-[5-[[(4-fluorophenyl)methylamino]methyl]-2-methoxyphenyl]-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide Traditional Name: 3-[5-[[(4-fluorobenzyl)amino]methyl]-2-methoxy-phenyl]-N-(2-pyrrolidinoethyl)benzenesulfonamide Formula: C27H32FN3O3S MolecularWeight: 497.624683

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNCC2=CC=C(C=C2)F)C3=CC(=CC=C3)S(=O)(=O)NCCN4CCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)CNCC2=CC=C(C=C2)F)C3=CC(=CC=C3)S(=O)(=O)NCCN4CCCC4

InChI

InChI=1S/C27H32FN3O3S/c1-34-27-12-9-22(20-29-19-21-7-10-24(28)11-8-21)17-26(27)23-5-4-6-25(18-23)35(32,33)30-13-16-31-14-2-3-15-31/h4-12,17-18,29-30H,2-3,13-16,19-20H2,1H3