N-[(3R)-1-[3-[4-(4-cyanophenyl)phenoxy]propyl]pyrrolidin-3-yl]-4-ethyl-benzenesulfonamide

Systemtic Name: N-[(3R)-1-[3-[4-(4-cyanophenyl)phenoxy]propyl]pyrrolidin-3-yl]-4-ethyl-benzenesulfonamide Openeye Name: N-[(3R)-1-[3-[4-(4-cyanophenyl)phenoxy]propyl]pyrrolidin-3-yl]-4-ethyl-benzenesulfonamide CAS Name: N-[(3R)-1-[3-[4-(4-cyanophenyl)phenoxy]propyl]-3-pyrrolidinyl]-4-ethylbenzenesulfonamide IUPAC Name: N-[(3R)-1-[3-[4-(4-cyanophenyl)phenoxy]propyl]pyrrolidin-3-yl]-4-ethylbenzenesulfonamide Traditional Name: N-[(3R)-1-[3-[4-(4-cyanophenyl)phenoxy]propyl]pyrrolidin-3-yl]-4-ethyl-benzenesulfonamide Formula: C28H31N3O3S MolecularWeight: 489.62904

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)S(=O)(=O)NC2CCN(C2)CCCOC3=CC=C(C=C3)C4=CC=C(C=C4)C#N

Isomeric SMILES

CCC1=CC=C(C=C1)S(=O)(=O)N[C@@H]2CCN(C2)CCCOC3=CC=C(C=C3)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C28H31N3O3S/c1-2-22-6-14-28(15-7-22)35(32,33)30-26-16-18-31(21-26)17-3-19-34-27-12-10-25(11-13-27)24-8-4-23(20-29)5-9-24/h4-15,26,30H,2-3,16-19,21H2,1H3/t26-/m1/s1