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

Systemtic Name: N-[3-[3-[(2-methyl-4-oxidanylidene-6,7-dihydro-5H-1-benzothiophen-5-yl)methylamino]-2-oxidanyl-cyclopentyl]oxyphenyl]methanesulfonamide Openeye Name: N-[3-[2-hydroxy-3-[(2-methyl-4-oxo-6,7-dihydro-5H-benzothiophen-5-yl)methylamino]cyclopentoxy]phenyl]methanesulfonamide CAS Name: N-[3-[2-hydroxy-3-[(2-methyl-4-oxo-6,7-dihydro-5H-1-benzothiophen-5-yl)methylamino]cyclopentyl]oxyphenyl]methanesulfonamide IUPAC Name: N-[3-[2-hydroxy-3-[(2-methyl-4-oxo-6,7-dihydro-5H-1-benzothiophen-5-yl)methylamino]cyclopentyl]oxyphenyl]methanesulfonamide Traditional Name: N-[3-[2-hydroxy-3-[(4-keto-2-methyl-6,7-dihydro-5H-benzothiophen-5-yl)methylamino]cyclopentoxy]phenyl]methanesulfonamide Formula: C22H28N2O5S2 MolecularWeight: 464.59812

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H28N2O5S2/c1-13-10-17-20(30-13)9-6-14(21(17)25)12-23-18-7-8-19(22(18)26)29-16-5-3-4-15(11-16)24-31(2,27)28/h3-5,10-11,14,18-19,22-24,26H,6-9,12H2,1-2H3