3-cyano-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methyl-propyl]benzenesulfonamide

Systemtic Name: 3-cyano-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methyl-propyl]benzenesulfonamide Openeye Name: 3-cyano-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methyl-propyl]benzenesulfonamide CAS Name: 3-cyano-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methylpropyl]benzenesulfonamide IUPAC Name: 3-cyano-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methylpropyl]benzenesulfonamide Traditional Name: 3-cyano-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methyl-propyl]benzenesulfonamide Formula: C20H23N3O2S MolecularWeight: 369.48052

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CNS(=O)(=O)C1=CC=CC(=C1)C#N)N2CCC3=CC=CC=C3C2

Isomeric SMILES

CC(C)(CNS(=O)(=O)C1=CC=CC(=C1)C#N)N2CCC3=CC=CC=C3C2

InChI

InChI=1S/C20H23N3O2S/c1-20(2,23-11-10-17-7-3-4-8-18(17)14-23)15-22-26(24,25)19-9-5-6-16(12-19)13-21/h3-9,12,22H,10-11,14-15H2,1-2H3