N-[1-[3-[4-(4-cyanophenyl)phenoxy]propyl]pyrrolidin-3-yl]-N-methyl-4-methylsulfonyl-benzenesulfonamide

Systemtic Name: N-[1-[3-[4-(4-cyanophenyl)phenoxy]propyl]pyrrolidin-3-yl]-N-methyl-4-methylsulfonyl-benzenesulfonamide Openeye Name: N-[1-[3-[4-(4-cyanophenyl)phenoxy]propyl]pyrrolidin-3-yl]-N-methyl-4-methylsulfonyl-benzenesulfonamide CAS Name: N-[1-[3-[4-(4-cyanophenyl)phenoxy]propyl]-3-pyrrolidinyl]-N-methyl-4-methylsulfonylbenzenesulfonamide IUPAC Name: N-[1-[3-[4-(4-cyanophenyl)phenoxy]propyl]pyrrolidin-3-yl]-N-methyl-4-methylsulfonylbenzenesulfonamide Traditional Name: N-[1-[3-[4-(4-cyanophenyl)phenoxy]propyl]pyrrolidin-3-yl]-4-mesyl-N-methyl-benzenesulfonamide Formula: C28H31N3O5S2 MolecularWeight: 553.69284

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCN(C1)CCCOC2=CC=C(C=C2)C3=CC=C(C=C3)C#N)S(=O)(=O)C4=CC=C(C=C4)S(=O)(=O)C

Isomeric SMILES

CN(C1CCN(C1)CCCOC2=CC=C(C=C2)C3=CC=C(C=C3)C#N)S(=O)(=O)C4=CC=C(C=C4)S(=O)(=O)C

InChI

InChI=1S/C28H31N3O5S2/c1-30(38(34,35)28-14-12-27(13-15-28)37(2,32)33)25-16-18-31(21-25)17-3-19-36-26-10-8-24(9-11-26)23-6-4-22(20-29)5-7-23/h4-15,25H,3,16-19,21H2,1-2H3