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

Systemtic Name: 2-methyl-5-[[(3-naphthalen-1-yloxy-2-oxidanyl-cyclopentyl)amino]methyl]-6,7-dihydro-5H-1-benzothiophen-4-one hydrochloride Openeye Name: 5-[[[2-hydroxy-3-(1-naphthyloxy)cyclopentyl]amino]methyl]-2-methyl-6,7-dihydro-5H-benzothiophen-4-one hydrochloride CAS Name: 5-[[[2-hydroxy-3-(1-naphthalenyloxy)cyclopentyl]amino]methyl]-2-methyl-6,7-dihydro-5H-1-benzothiophen-4-one hydrochloride IUPAC Name: 5-[[(2-hydroxy-3-naphthalen-1-yloxycyclopentyl)amino]methyl]-2-methyl-6,7-dihydro-5H-1-benzothiophen-4-one hydrochloride Traditional Name: 5-[[[2-hydroxy-3-(1-naphthoxy)cyclopentyl]amino]methyl]-2-methyl-6,7-dihydro-5H-benzothiophen-4-one hydrochloride Formula: C25H28ClNO3S MolecularWeight: 458.01272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(S1)CCC(C2=O)CNC3CCC(C3O)OC4=CC=CC5=CC=CC=C54.Cl

Isomeric SMILES

CC1=CC2=C(S1)CCC(C2=O)CNC3CCC(C3O)OC4=CC=CC5=CC=CC=C54.Cl

InChI

InChI=1S/C25H27NO3S.ClH/c1-15-13-19-23(30-15)12-9-17(24(19)27)14-26-20-10-11-22(25(20)28)29-21-8-4-6-16-5-2-3-7-18(16)21;/h2-8,13,17,20,22,25-26,28H,9-12,14H2,1H3;1H