N-[5-[3-[[1-(4-cyanophenyl)-2-phenyl-ethyl]amino]-2-oxidanyl-propyl]-2-oxidanyl-phenyl]methanesulfonamide

Systemtic Name: N-[5-[3-[[1-(4-cyanophenyl)-2-phenyl-ethyl]amino]-2-oxidanyl-propyl]-2-oxidanyl-phenyl]methanesulfonamide Openeye Name: N-[5-[3-[[1-(4-cyanophenyl)-2-phenyl-ethyl]amino]-2-hydroxy-propyl]-2-hydroxy-phenyl]methanesulfonamide CAS Name: N-[5-[3-[[1-(4-cyanophenyl)-2-phenylethyl]amino]-2-hydroxypropyl]-2-hydroxyphenyl]methanesulfonamide IUPAC Name: N-[5-[3-[[1-(4-cyanophenyl)-2-phenylethyl]amino]-2-hydroxypropyl]-2-hydroxyphenyl]methanesulfonamide Traditional Name: N-[5-[3-[[1-(4-cyanophenyl)-2-phenyl-ethyl]amino]-2-hydroxy-propyl]-2-hydroxy-phenyl]methanesulfonamide Formula: C25H27N3O4S MolecularWeight: 465.56458

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=C(C=CC(=C1)CC(CNC(CC2=CC=CC=C2)C3=CC=C(C=C3)C#N)O)O

Isomeric SMILES

CS(=O)(=O)NC1=C(C=CC(=C1)CC(CNC(CC2=CC=CC=C2)C3=CC=C(C=C3)C#N)O)O

InChI

InChI=1S/C25H27N3O4S/c1-33(31,32)28-24-15-20(9-12-25(24)30)13-22(29)17-27-23(14-18-5-3-2-4-6-18)21-10-7-19(16-26)8-11-21/h2-12,15,22-23,27-30H,13-14,17H2,1H3