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

Systemtic Name: 4-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]-N-methyl-benzenesulfonamide dihydrochloride Openeye Name: 4-[1-(4-ethylpiperazin-1-yl)-3-isoquinolyl]-N-methyl-benzenesulfonamide dihydrochloride CAS Name: 4-[1-(4-ethyl-1-piperazinyl)-3-isoquinolinyl]-N-methylbenzenesulfonamide dihydrochloride IUPAC Name: 4-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]-N-methylbenzenesulfonamide dihydrochloride Traditional Name: 4-[1-(4-ethylpiperazino)-3-isoquinolyl]-N-methyl-benzenesulfonamide dihydrochloride Formula: C22H28Cl2N4O2S MolecularWeight: 483.45432

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26N4O2S.2ClH/c1-3-25-12-14-26(15-13-25)22-20-7-5-4-6-18(20)16-21(24-22)17-8-10-19(11-9-17)29(27,28)23-2;;/h4-11,16,23H,3,12-15H2,1-2H3;2*1H