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

Systemtic Name: N,N-diethyl-4-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]benzenesulfonamide dihydrochloride Openeye Name: N,N-diethyl-4-[1-(4-ethylpiperazin-1-yl)-3-isoquinolyl]benzenesulfonamide dihydrochloride CAS Name: N,N-diethyl-4-[1-(4-ethyl-1-piperazinyl)-3-isoquinolinyl]benzenesulfonamide dihydrochloride IUPAC Name: N,N-diethyl-4-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]benzenesulfonamide dihydrochloride Traditional Name: N,N-diethyl-4-[1-(4-ethylpiperazino)-3-isoquinolyl]benzenesulfonamide dihydrochloride Formula: C25H34Cl2N4O2S MolecularWeight: 525.53406

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H32N4O2S.2ClH/c1-4-27-15-17-28(18-16-27)25-23-10-8-7-9-21(23)19-24(26-25)20-11-13-22(14-12-20)32(30,31)29(5-2)6-3;;/h7-14,19H,4-6,15-18H2,1-3H3;2*1H