N-[(2S)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-methyl-1-oxidanylidene-butan-2-yl]-4-methoxy-benzenesulfonamide

Systemtic Name: N-[(2S)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-methyl-1-oxidanylidene-butan-2-yl]-4-methoxy-benzenesulfonamide Openeye Name: N-[(1S)-1-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-2-methyl-propyl]-4-methoxy-benzenesulfonamide CAS Name: N-[(2S)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-methyl-1-oxobutan-2-yl]-4-methoxybenzenesulfonamide IUPAC Name: N-[(2S)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-methyl-1-oxobutan-2-yl]-4-methoxybenzenesulfonamide Traditional Name: N-[(1S)-1-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-2-methyl-propyl]-4-methoxy-benzenesulfonamide Formula: C21H26N2O4S MolecularWeight: 402.50714

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CCC2=CC=CC=C2C1)NS(=O)(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)[C@@H](C(=O)N1CCC2=CC=CC=C2C1)NS(=O)(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H26N2O4S/c1-15(2)20(22-28(25,26)19-10-8-18(27-3)9-11-19)21(24)23-13-12-16-6-4-5-7-17(16)14-23/h4-11,15,20,22H,12-14H2,1-3H3/t20-/m0/s1