N-[[4-[1-[4-(2-hydroxyethyl)piperazin-1-yl]-2H-isoquinolin-1-yl]phenyl]methyl]ethanesulfonamide

Systemtic Name: N-[[4-[1-[4-(2-hydroxyethyl)piperazin-1-yl]-2H-isoquinolin-1-yl]phenyl]methyl]ethanesulfonamide Openeye Name: N-[[4-[1-[4-(2-hydroxyethyl)piperazin-1-yl]-2H-isoquinolin-1-yl]phenyl]methyl]ethanesulfonamide CAS Name: N-[[4-[1-[4-(2-hydroxyethyl)-1-piperazinyl]-2H-isoquinolin-1-yl]phenyl]methyl]ethanesulfonamide IUPAC Name: N-[[4-[1-[4-(2-hydroxyethyl)piperazin-1-yl]-2H-isoquinolin-1-yl]phenyl]methyl]ethanesulfonamide Traditional Name: N-[4-[1-[4-(2-hydroxyethyl)piperazino]-2H-isoquinolin-1-yl]benzyl]ethanesulfonamide Formula: C24H32N4O3S MolecularWeight: 456.60088

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)NCC1=CC=C(C=C1)C2(C3=CC=CC=C3C=CN2)N4CCN(CC4)CCO

Isomeric SMILES

CCS(=O)(=O)NCC1=CC=C(C=C1)C2(C3=CC=CC=C3C=CN2)N4CCN(CC4)CCO

InChI

InChI=1S/C24H32N4O3S/c1-2-32(30,31)26-19-20-7-9-22(10-8-20)24(28-15-13-27(14-16-28)17-18-29)23-6-4-3-5-21(23)11-12-25-24/h3-12,25-26,29H,2,13-19H2,1H3