N-[[2-chloranyl-4-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]phenyl]methyl]ethanesulfonamide

Systemtic Name: N-[[2-chloranyl-4-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]phenyl]methyl]ethanesulfonamide Openeye Name: N-[[2-chloro-4-[1-(4-ethylpiperazin-1-yl)-3-isoquinolyl]phenyl]methyl]ethanesulfonamide CAS Name: N-[[2-chloro-4-[1-(4-ethyl-1-piperazinyl)-3-isoquinolinyl]phenyl]methyl]ethanesulfonamide IUPAC Name: N-[[2-chloro-4-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]phenyl]methyl]ethanesulfonamide Traditional Name: N-[2-chloro-4-[1-(4-ethylpiperazino)-3-isoquinolyl]benzyl]ethanesulfonamide Formula: C24H29ClN4O2S MolecularWeight: 473.03066

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=NC(=CC3=CC=CC=C32)C4=CC(=C(C=C4)CNS(=O)(=O)CC)Cl

Isomeric SMILES

CCN1CCN(CC1)C2=NC(=CC3=CC=CC=C32)C4=CC(=C(C=C4)CNS(=O)(=O)CC)Cl

InChI

InChI=1S/C24H29ClN4O2S/c1-3-28-11-13-29(14-12-28)24-21-8-6-5-7-18(21)16-23(27-24)19-9-10-20(22(25)15-19)17-26-32(30,31)4-2/h5-10,15-16,26H,3-4,11-14,17H2,1-2H3