4-[7-(1-ethylsulfonylpiperidin-4-yl)oxyisoquinolin-6-yl]benzenesulfonamide

Systemtic Name: 4-[7-(1-ethylsulfonylpiperidin-4-yl)oxyisoquinolin-6-yl]benzenesulfonamide Openeye Name: 4-[7-[(1-ethylsulfonyl-4-piperidyl)oxy]-6-isoquinolyl]benzenesulfonamide CAS Name: 4-[7-[(1-ethylsulfonyl-4-piperidinyl)oxy]-6-isoquinolinyl]benzenesulfonamide IUPAC Name: 4-[7-(1-ethylsulfonylpiperidin-4-yl)oxyisoquinolin-6-yl]benzenesulfonamide Traditional Name: 4-[7-[(1-esyl-4-piperidyl)oxy]-6-isoquinolyl]benzenesulfonamide Formula: C22H25N3O5S2 MolecularWeight: 475.581

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCC(CC1)OC2=C(C=C3C=CN=CC3=C2)C4=CC=C(C=C4)S(=O)(=O)N

Isomeric SMILES

CCS(=O)(=O)N1CCC(CC1)OC2=C(C=C3C=CN=CC3=C2)C4=CC=C(C=C4)S(=O)(=O)N

InChI

InChI=1S/C22H25N3O5S2/c1-2-31(26,27)25-11-8-19(9-12-25)30-22-14-18-15-24-10-7-17(18)13-21(22)16-3-5-20(6-4-16)32(23,28)29/h3-7,10,13-15,19H,2,8-9,11-12H2,1H3,(H2,23,28,29)