N-[4-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]phenyl]propane-1-sulfonamide hydrochloride

Systemtic Name: N-[4-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]phenyl]propane-1-sulfonamide hydrochloride Openeye Name: N-[4-[1-(4-ethylpiperazin-1-yl)-3-isoquinolyl]phenyl]propane-1-sulfonamide hydrochloride CAS Name: N-[4-[1-(4-ethyl-1-piperazinyl)-3-isoquinolinyl]phenyl]-1-propanesulfonamide hydrochloride IUPAC Name: N-[4-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]phenyl]propane-1-sulfonamide hydrochloride Traditional Name: N-[4-[1-(4-ethylpiperazino)-3-isoquinolyl]phenyl]propane-1-sulfonamide hydrochloride Formula: C24H31ClN4O2S MolecularWeight: 475.04654

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)NC1=CC=C(C=C1)C2=CC3=CC=CC=C3C(=N2)N4CCN(CC4)CC.Cl

Isomeric SMILES

CCCS(=O)(=O)NC1=CC=C(C=C1)C2=CC3=CC=CC=C3C(=N2)N4CCN(CC4)CC.Cl

InChI

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