N-[(2-fluorophenyl)methyl]-N-phenethyl-4-pyrrolidin-1-ylsulfonyl-benzenesulfonamide

Systemtic Name: N-[(2-fluorophenyl)methyl]-N-phenethyl-4-pyrrolidin-1-ylsulfonyl-benzenesulfonamide Openeye Name: N-[(2-fluorophenyl)methyl]-N-phenethyl-4-pyrrolidin-1-ylsulfonyl-benzenesulfonamide CAS Name: N-[(2-fluorophenyl)methyl]-N-phenethyl-4-(1-pyrrolidinylsulfonyl)benzenesulfonamide IUPAC Name: N-[(2-fluorophenyl)methyl]-N-phenethyl-4-pyrrolidin-1-ylsulfonylbenzenesulfonamide Traditional Name: N-(2-fluorobenzyl)-N-phenethyl-4-pyrrolidinosulfonyl-benzenesulfonamide Formula: C25H27FN2O4S2 MolecularWeight: 502.621283

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N(CCC3=CC=CC=C3)CC4=CC=CC=C4F

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N(CCC3=CC=CC=C3)CC4=CC=CC=C4F

InChI

InChI=1S/C25H27FN2O4S2/c26-25-11-5-4-10-22(25)20-28(19-16-21-8-2-1-3-9-21)34(31,32)24-14-12-23(13-15-24)33(29,30)27-17-6-7-18-27/h1-5,8-15H,6-7,16-20H2