3-(cyclobutylamino)-5-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-N,N-dimethyl-benzenesulfonamide

Systemtic Name: 3-(cyclobutylamino)-5-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-N,N-dimethyl-benzenesulfonamide Openeye Name: 3-(cyclobutylamino)-5-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-N,N-dimethyl-benzenesulfonamide CAS Name: 3-(cyclobutylamino)-5-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]-N,N-dimethylbenzenesulfonamide IUPAC Name: 3-(cyclobutylamino)-5-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-N,N-dimethylbenzenesulfonamide Traditional Name: 3-(cyclobutylamino)-5-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-N,N-dimethyl-benzenesulfonamide Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC(=CC(=C1)NC2CCC2)C(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC(=CC(=C1)NC2CCC2)C(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C22H27N3O3S/c1-24(2)29(27,28)21-13-18(12-20(14-21)23-19-8-5-9-19)22(26)25-11-10-16-6-3-4-7-17(16)15-25/h3-4,6-7,12-14,19,23H,5,8-11,15H2,1-2H3