N-[(2S)-1-isoquinolin-5-yloxypropan-2-yl]-2,4,6-trimethyl-benzenesulfonamide

Systemtic Name: N-[(2S)-1-isoquinolin-5-yloxypropan-2-yl]-2,4,6-trimethyl-benzenesulfonamide Openeye Name: N-[(1S)-2-(5-isoquinolyloxy)-1-methyl-ethyl]-2,4,6-trimethyl-benzenesulfonamide CAS Name: N-[(2S)-1-(5-isoquinolinyloxy)propan-2-yl]-2,4,6-trimethylbenzenesulfonamide IUPAC Name: N-[(2S)-1-isoquinolin-5-yloxypropan-2-yl]-2,4,6-trimethylbenzenesulfonamide Traditional Name: N-[(1S)-2-(5-isoquinolyloxy)-1-methyl-ethyl]-2,4,6-trimethyl-benzenesulfonamide Formula: C21H24N2O3S MolecularWeight: 384.49186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)NC(C)COC2=CC=CC3=C2C=CN=C3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N[C@@H](C)COC2=CC=CC3=C2C=CN=C3)C

InChI

InChI=1S/C21H24N2O3S/c1-14-10-15(2)21(16(3)11-14)27(24,25)23-17(4)13-26-20-7-5-6-18-12-22-9-8-19(18)20/h5-12,17,23H,13H2,1-4H3/t17-/m0/s1