N-[4-(3,4-dihydroisoquinolin-1-yl)phenyl]-5-(dimethylamino)naphthalene-1-sulfonamide

Systemtic Name: N-[4-(3,4-dihydroisoquinolin-1-yl)phenyl]-5-(dimethylamino)naphthalene-1-sulfonamide Openeye Name: N-[4-(3,4-dihydroisoquinolin-1-yl)phenyl]-5-(dimethylamino)naphthalene-1-sulfonamide CAS Name: N-[4-(3,4-dihydroisoquinolin-1-yl)phenyl]-5-(dimethylamino)-1-naphthalenesulfonamide IUPAC Name: N-[4-(3,4-dihydroisoquinolin-1-yl)phenyl]-5-(dimethylamino)naphthalene-1-sulfonamide Traditional Name: N-[4-(3,4-dihydroisoquinolin-1-yl)phenyl]-5-(dimethylamino)naphthalene-1-sulfonamide Formula: C27H25N3O2S MolecularWeight: 455.5713

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=CC2=C1C=CC=C2S(=O)(=O)NC3=CC=C(C=C3)C4=NCCC5=CC=CC=C54

Isomeric SMILES

CN(C)C1=CC=CC2=C1C=CC=C2S(=O)(=O)NC3=CC=C(C=C3)C4=NCCC5=CC=CC=C54

InChI

InChI=1S/C27H25N3O2S/c1-30(2)25-11-5-10-24-23(25)9-6-12-26(24)33(31,32)29-21-15-13-20(14-16-21)27-22-8-4-3-7-19(22)17-18-28-27/h3-16,29H,17-18H2,1-2H3