2-methyl-5-[[[2-oxidanyl-3-(2-propan-2-ylphenoxy)cyclopentyl]amino]methyl]-6,7-dihydro-5H-1-benzothiophen-4-one hydrochloride

Systemtic Name: 2-methyl-5-[[[2-oxidanyl-3-(2-propan-2-ylphenoxy)cyclopentyl]amino]methyl]-6,7-dihydro-5H-1-benzothiophen-4-one hydrochloride Openeye Name: 5-[[[2-hydroxy-3-(2-isopropylphenoxy)cyclopentyl]amino]methyl]-2-methyl-6,7-dihydro-5H-benzothiophen-4-one hydrochloride CAS Name: 5-[[[2-hydroxy-3-(2-propan-2-ylphenoxy)cyclopentyl]amino]methyl]-2-methyl-6,7-dihydro-5H-1-benzothiophen-4-one hydrochloride IUPAC Name: 5-[[[2-hydroxy-3-(2-propan-2-ylphenoxy)cyclopentyl]amino]methyl]-2-methyl-6,7-dihydro-5H-1-benzothiophen-4-one hydrochloride Traditional Name: 5-[[[2-hydroxy-3-(2-isopropylphenoxy)cyclopentyl]amino]methyl]-2-methyl-6,7-dihydro-5H-benzothiophen-4-one hydrochloride Formula: C24H32ClNO3S MolecularWeight: 450.03378

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(S1)CCC(C2=O)CNC3CCC(C3O)OC4=CC=CC=C4C(C)C.Cl

Isomeric SMILES

CC1=CC2=C(S1)CCC(C2=O)CNC3CCC(C3O)OC4=CC=CC=C4C(C)C.Cl

InChI

InChI=1S/C24H31NO3S.ClH/c1-14(2)17-6-4-5-7-20(17)28-21-10-9-19(24(21)27)25-13-16-8-11-22-18(23(16)26)12-15(3)29-22;/h4-7,12,14,16,19,21,24-25,27H,8-11,13H2,1-3H3;1H