N-[4-[(4-methoxyphenoxy)methyl]-2-(quinolin-2-ylmethylamino)phenyl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[4-[(4-methoxyphenoxy)methyl]-2-(quinolin-2-ylmethylamino)phenyl]-4-methyl-benzenesulfonamide Openeye Name: N-[4-[(4-methoxyphenoxy)methyl]-2-(2-quinolylmethylamino)phenyl]-4-methyl-benzenesulfonamide CAS Name: N-[4-[(4-methoxyphenoxy)methyl]-2-(2-quinolinylmethylamino)phenyl]-4-methylbenzenesulfonamide IUPAC Name: N-[4-[(4-methoxyphenoxy)methyl]-2-(quinolin-2-ylmethylamino)phenyl]-4-methylbenzenesulfonamide Traditional Name: N-[4-[(4-methoxyphenoxy)methyl]-2-(2-quinolylmethylamino)phenyl]-4-methyl-benzenesulfonamide Formula: C31H29N3O4S MolecularWeight: 539.64466

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=C(C=C2)COC3=CC=C(C=C3)OC)NCC4=NC5=CC=CC=C5C=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=C(C=C2)COC3=CC=C(C=C3)OC)NCC4=NC5=CC=CC=C5C=C4

InChI

InChI=1S/C31H29N3O4S/c1-22-7-16-28(17-8-22)39(35,36)34-30-18-9-23(21-38-27-14-12-26(37-2)13-15-27)19-31(30)32-20-25-11-10-24-5-3-4-6-29(24)33-25/h3-19,32,34H,20-21H2,1-2H3