2-methyl-5-[[[3-(4-methylsulfanylphenoxy)-2-oxidanyl-cyclopentyl]amino]methyl]-1,5,6,7-tetrahydroindol-4-one

Systemtic Name: 2-methyl-5-[[[3-(4-methylsulfanylphenoxy)-2-oxidanyl-cyclopentyl]amino]methyl]-1,5,6,7-tetrahydroindol-4-one Openeye Name: 5-[[[2-hydroxy-3-(4-methylsulfanylphenoxy)cyclopentyl]amino]methyl]-2-methyl-1,5,6,7-tetrahydroindol-4-one CAS Name: 5-[[[2-hydroxy-3-[4-(methylthio)phenoxy]cyclopentyl]amino]methyl]-2-methyl-1,5,6,7-tetrahydroindol-4-one IUPAC Name: 5-[[[2-hydroxy-3-(4-methylsulfanylphenoxy)cyclopentyl]amino]methyl]-2-methyl-1,5,6,7-tetrahydroindol-4-one Traditional Name: 5-[[[2-hydroxy-3-[4-(methylthio)phenoxy]cyclopentyl]amino]methyl]-2-methyl-1,5,6,7-tetrahydroindol-4-one Formula: C22H28N2O3S MolecularWeight: 400.53432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(N1)CCC(C2=O)CNC3CCC(C3O)OC4=CC=C(C=C4)SC

Isomeric SMILES

CC1=CC2=C(N1)CCC(C2=O)CNC3CCC(C3O)OC4=CC=C(C=C4)SC

InChI

InChI=1S/C22H28N2O3S/c1-13-11-17-18(24-13)8-3-14(21(17)25)12-23-19-9-10-20(22(19)26)27-15-4-6-16(28-2)7-5-15/h4-7,11,14,19-20,22-24,26H,3,8-10,12H2,1-2H3