N-[2-(4-azanylbutyl)-3,4-dihydro-1H-isoquinolin-7-yl]-4-cyano-benzenesulfonamide

Systemtic Name: N-[2-(4-azanylbutyl)-3,4-dihydro-1H-isoquinolin-7-yl]-4-cyano-benzenesulfonamide Openeye Name: N-[2-(4-aminobutyl)-3,4-dihydro-1H-isoquinolin-7-yl]-4-cyano-benzenesulfonamide CAS Name: N-[2-(4-aminobutyl)-3,4-dihydro-1H-isoquinolin-7-yl]-4-cyanobenzenesulfonamide IUPAC Name: N-[2-(4-aminobutyl)-3,4-dihydro-1H-isoquinolin-7-yl]-4-cyanobenzenesulfonamide Traditional Name: N-[2-(4-aminobutyl)-3,4-dihydro-1H-isoquinolin-7-yl]-4-cyano-benzenesulfonamide Formula: C20H24N4O2S MolecularWeight: 384.49516

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1C=CC(=C2)NS(=O)(=O)C3=CC=C(C=C3)C#N)CCCCN

Isomeric SMILES

C1CN(CC2=C1C=CC(=C2)NS(=O)(=O)C3=CC=C(C=C3)C#N)CCCCN

InChI

InChI=1S/C20H24N4O2S/c21-10-1-2-11-24-12-9-17-5-6-19(13-18(17)15-24)23-27(25,26)20-7-3-16(14-22)4-8-20/h3-8,13,23H,1-2,9-12,15,21H2