N-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]benzenesulfonamide

Systemtic Name: N-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]benzenesulfonamide Openeye Name: N-[1-(4-ethylpiperazin-1-yl)-3-isoquinolyl]benzenesulfonamide CAS Name: N-[1-(4-ethyl-1-piperazinyl)-3-isoquinolinyl]benzenesulfonamide IUPAC Name: N-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]benzenesulfonamide Traditional Name: N-[1-(4-ethylpiperazino)-3-isoquinolyl]benzenesulfonamide Formula: C21H24N4O2S MolecularWeight: 396.50586

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=NC(=CC3=CC=CC=C32)NS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CCN1CCN(CC1)C2=NC(=CC3=CC=CC=C32)NS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H24N4O2S/c1-2-24-12-14-25(15-13-24)21-19-11-7-6-8-17(19)16-20(22-21)23-28(26,27)18-9-4-3-5-10-18/h3-11,16H,2,12-15H2,1H3,(H,22,23)