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

Systemtic Name: N-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]-4-methoxy-benzenesulfonamide Openeye Name: N-[1-(4-ethylpiperazin-1-yl)-3-isoquinolyl]-4-methoxy-benzenesulfonamide CAS Name: N-[1-(4-ethyl-1-piperazinyl)-3-isoquinolinyl]-4-methoxybenzenesulfonamide IUPAC Name: N-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]-4-methoxybenzenesulfonamide Traditional Name: N-[1-(4-ethylpiperazino)-3-isoquinolyl]-4-methoxy-benzenesulfonamide Formula: C22H26N4O3S MolecularWeight: 426.53184

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26N4O3S/c1-3-25-12-14-26(15-13-25)22-20-7-5-4-6-17(20)16-21(23-22)24-30(27,28)19-10-8-18(29-2)9-11-19/h4-11,16H,3,12-15H2,1-2H3,(H,23,24)