4-[3-[(2-methyl-4-oxidanylidene-6,7-dihydro-5H-1-benzothiophen-5-yl)methylamino]-2-oxidanyl-cyclopentyl]oxybenzenesulfonamide

Systemtic Name: 4-[3-[(2-methyl-4-oxidanylidene-6,7-dihydro-5H-1-benzothiophen-5-yl)methylamino]-2-oxidanyl-cyclopentyl]oxybenzenesulfonamide Openeye Name: 4-[2-hydroxy-3-[(2-methyl-4-oxo-6,7-dihydro-5H-benzothiophen-5-yl)methylamino]cyclopentoxy]benzenesulfonamide CAS Name: 4-[2-hydroxy-3-[(2-methyl-4-oxo-6,7-dihydro-5H-1-benzothiophen-5-yl)methylamino]cyclopentyl]oxybenzenesulfonamide IUPAC Name: 4-[2-hydroxy-3-[(2-methyl-4-oxo-6,7-dihydro-5H-1-benzothiophen-5-yl)methylamino]cyclopentyl]oxybenzenesulfonamide Traditional Name: 4-[2-hydroxy-3-[(4-keto-2-methyl-6,7-dihydro-5H-benzothiophen-5-yl)methylamino]cyclopentoxy]benzenesulfonamide Formula: C21H26N2O5S2 MolecularWeight: 450.57154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(S1)CCC(C2=O)CNC3CCC(C3O)OC4=CC=C(C=C4)S(=O)(=O)N

Isomeric SMILES

CC1=CC2=C(S1)CCC(C2=O)CNC3CCC(C3O)OC4=CC=C(C=C4)S(=O)(=O)N

InChI

InChI=1S/C21H26N2O5S2/c1-12-10-16-19(29-12)9-2-13(20(16)24)11-23-17-7-8-18(21(17)25)28-14-3-5-15(6-4-14)30(22,26)27/h3-6,10,13,17-18,21,23,25H,2,7-9,11H2,1H3,(H2,22,26,27)