2-fluoranyl-4-[4-[[(phenylmethyl)amino]methyl]phenyl]-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide

Systemtic Name: 2-fluoranyl-4-[4-[[(phenylmethyl)amino]methyl]phenyl]-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide Openeye Name: 4-[4-[(benzylamino)methyl]phenyl]-2-fluoro-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide CAS Name: 2-fluoro-4-[4-[[(phenylmethyl)amino]methyl]phenyl]-N-[2-(1-pyrrolidinyl)ethyl]benzenesulfonamide IUPAC Name: 4-[4-[(benzylamino)methyl]phenyl]-2-fluoro-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide Traditional Name: 4-[4-[(benzylamino)methyl]phenyl]-2-fluoro-N-(2-pyrrolidinoethyl)benzenesulfonamide Formula: C26H30FN3O2S MolecularWeight: 467.598703

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCNS(=O)(=O)C2=C(C=C(C=C2)C3=CC=C(C=C3)CNCC4=CC=CC=C4)F

Isomeric SMILES

C1CCN(C1)CCNS(=O)(=O)C2=C(C=C(C=C2)C3=CC=C(C=C3)CNCC4=CC=CC=C4)F

InChI

InChI=1S/C26H30FN3O2S/c27-25-18-24(12-13-26(25)33(31,32)29-14-17-30-15-4-5-16-30)23-10-8-22(9-11-23)20-28-19-21-6-2-1-3-7-21/h1-3,6-13,18,28-29H,4-5,14-17,19-20H2