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

Systemtic Name: N-ethyl-4-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]benzenesulfonamide dihydrochloride Openeye Name: N-ethyl-4-[1-(4-ethylpiperazin-1-yl)-3-isoquinolyl]benzenesulfonamide dihydrochloride CAS Name: N-ethyl-4-[1-(4-ethyl-1-piperazinyl)-3-isoquinolinyl]benzenesulfonamide dihydrochloride IUPAC Name: N-ethyl-4-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]benzenesulfonamide dihydrochloride Traditional Name: N-ethyl-4-[1-(4-ethylpiperazino)-3-isoquinolyl]benzenesulfonamide dihydrochloride Formula: C23H30Cl2N4O2S MolecularWeight: 497.4809

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H28N4O2S.2ClH/c1-3-24-30(28,29)20-11-9-18(10-12-20)22-17-19-7-5-6-8-21(19)23(25-22)27-15-13-26(4-2)14-16-27;;/h5-12,17,24H,3-4,13-16H2,1-2H3;2*1H