N-ethyl-4-[1-[4-(2-hydroxyethyl)piperazin-1-yl]isoquinolin-3-yl]benzenesulfonamide

Systemtic Name: N-ethyl-4-[1-[4-(2-hydroxyethyl)piperazin-1-yl]isoquinolin-3-yl]benzenesulfonamide Openeye Name: N-ethyl-4-[1-[4-(2-hydroxyethyl)piperazin-1-yl]-3-isoquinolyl]benzenesulfonamide CAS Name: N-ethyl-4-[1-[4-(2-hydroxyethyl)-1-piperazinyl]-3-isoquinolinyl]benzenesulfonamide IUPAC Name: N-ethyl-4-[1-[4-(2-hydroxyethyl)piperazin-1-yl]isoquinolin-3-yl]benzenesulfonamide Traditional Name: N-ethyl-4-[1-[4-(2-hydroxyethyl)piperazino]-3-isoquinolyl]benzenesulfonamide Formula: C23H28N4O3S MolecularWeight: 440.55842

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Descriptors Computed from Structure

Canonical SMILES:

CCNS(=O)(=O)C1=CC=C(C=C1)C2=CC3=CC=CC=C3C(=N2)N4CCN(CC4)CCO

Isomeric SMILES

CCNS(=O)(=O)C1=CC=C(C=C1)C2=CC3=CC=CC=C3C(=N2)N4CCN(CC4)CCO

InChI

InChI=1S/C23H28N4O3S/c1-2-24-31(29,30)20-9-7-18(8-10-20)22-17-19-5-3-4-6-21(19)23(25-22)27-13-11-26(12-14-27)15-16-28/h3-10,17,24,28H,2,11-16H2,1H3