4-cyano-N-[(3S)-1-[3-(4-ethanoylphenoxy)propyl]pyrrolidin-3-yl]benzenesulfonamide

Systemtic Name: 4-cyano-N-[(3S)-1-[3-(4-ethanoylphenoxy)propyl]pyrrolidin-3-yl]benzenesulfonamide Openeye Name: N-[(3S)-1-[3-(4-acetylphenoxy)propyl]pyrrolidin-3-yl]-4-cyano-benzenesulfonamide CAS Name: N-[(3S)-1-[3-(4-acetylphenoxy)propyl]-3-pyrrolidinyl]-4-cyanobenzenesulfonamide IUPAC Name: N-[(3S)-1-[3-(4-acetylphenoxy)propyl]pyrrolidin-3-yl]-4-cyanobenzenesulfonamide Traditional Name: N-[(3S)-1-[3-(4-acetylphenoxy)propyl]pyrrolidin-3-yl]-4-cyano-benzenesulfonamide Formula: C22H25N3O4S MolecularWeight: 427.5166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)OCCCN2CCC(C2)NS(=O)(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)OCCCN2CC[C@@H](C2)NS(=O)(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C22H25N3O4S/c1-17(26)19-5-7-21(8-6-19)29-14-2-12-25-13-11-20(16-25)24-30(27,28)22-9-3-18(15-23)4-10-22/h3-10,20,24H,2,11-14,16H2,1H3/t20-/m0/s1