N-[(1R,3S)-3-(3,4-dihydro-1H-isoquinolin-2-yl)cyclopentyl]-N,3-dimethyl-benzenesulfonamide

Systemtic Name: N-[(1R,3S)-3-(3,4-dihydro-1H-isoquinolin-2-yl)cyclopentyl]-N,3-dimethyl-benzenesulfonamide Openeye Name: N-[(1R,3S)-3-(3,4-dihydro-1H-isoquinolin-2-yl)cyclopentyl]-N,3-dimethyl-benzenesulfonamide CAS Name: N-[(1R,3S)-3-(3,4-dihydro-1H-isoquinolin-2-yl)cyclopentyl]-N,3-dimethylbenzenesulfonamide IUPAC Name: N-[(1R,3S)-3-(3,4-dihydro-1H-isoquinolin-2-yl)cyclopentyl]-N,3-dimethylbenzenesulfonamide Traditional Name: N-[(1R,3S)-3-(3,4-dihydro-1H-isoquinolin-2-yl)cyclopentyl]-N,3-dimethyl-benzenesulfonamide Formula: C22H28N2O2S MolecularWeight: 384.53492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)S(=O)(=O)N(C)C2CCC(C2)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CC1=CC(=CC=C1)S(=O)(=O)N(C)[C@@H]2CC[C@@H](C2)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C22H28N2O2S/c1-17-6-5-9-22(14-17)27(25,26)23(2)20-10-11-21(15-20)24-13-12-18-7-3-4-8-19(18)16-24/h3-9,14,20-21H,10-13,15-16H2,1-2H3/t20-,21+/m1/s1