N-[2-[4-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]phenyl]ethyl]ethanesulfonamide

Systemtic Name: N-[2-[4-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]phenyl]ethyl]ethanesulfonamide Openeye Name: N-[2-[4-[1-(4-ethylpiperazin-1-yl)-3-isoquinolyl]phenyl]ethyl]ethanesulfonamide CAS Name: N-[2-[4-[1-(4-ethyl-1-piperazinyl)-3-isoquinolinyl]phenyl]ethyl]ethanesulfonamide IUPAC Name: N-[2-[4-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]phenyl]ethyl]ethanesulfonamide Traditional Name: N-[2-[4-[1-(4-ethylpiperazino)-3-isoquinolyl]phenyl]ethyl]ethanesulfonamide Formula: C25H32N4O2S MolecularWeight: 452.61218

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=NC(=CC3=CC=CC=C32)C4=CC=C(C=C4)CCNS(=O)(=O)CC

Isomeric SMILES

CCN1CCN(CC1)C2=NC(=CC3=CC=CC=C32)C4=CC=C(C=C4)CCNS(=O)(=O)CC

InChI

InChI=1S/C25H32N4O2S/c1-3-28-15-17-29(18-16-28)25-23-8-6-5-7-22(23)19-24(27-25)21-11-9-20(10-12-21)13-14-26-32(30,31)4-2/h5-12,19,26H,3-4,13-18H2,1-2H3