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

Systemtic Name: 4-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]-N-propyl-benzenesulfonamide dihydrochloride Openeye Name: 4-[1-(4-ethylpiperazin-1-yl)-3-isoquinolyl]-N-propyl-benzenesulfonamide dihydrochloride CAS Name: 4-[1-(4-ethyl-1-piperazinyl)-3-isoquinolinyl]-N-propylbenzenesulfonamide dihydrochloride IUPAC Name: 4-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]-N-propylbenzenesulfonamide dihydrochloride Traditional Name: 4-[1-(4-ethylpiperazino)-3-isoquinolyl]-N-propyl-benzenesulfonamide dihydrochloride Formula: C24H32Cl2N4O2S MolecularWeight: 511.50748

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Descriptors Computed from Structure

Canonical SMILES:

CCCNS(=O)(=O)C1=CC=C(C=C1)C2=CC3=CC=CC=C3C(=N2)N4CCN(CC4)CC.Cl.Cl

Isomeric SMILES

CCCNS(=O)(=O)C1=CC=C(C=C1)C2=CC3=CC=CC=C3C(=N2)N4CCN(CC4)CC.Cl.Cl

InChI

InChI=1S/C24H30N4O2S.2ClH/c1-3-13-25-31(29,30)21-11-9-19(10-12-21)23-18-20-7-5-6-8-22(20)24(26-23)28-16-14-27(4-2)15-17-28;;/h5-12,18,25H,3-4,13-17H2,1-2H3;2*1H