2-(1H-indol-3-yl)ethyl-[[2-[(2S)-2-oxidanyl-3-thiomorpholin-4-ium-4-yl-propoxy]phenyl]methyl]azanium

Systemtic Name: 2-(1H-indol-3-yl)ethyl-[[2-[(2S)-2-oxidanyl-3-thiomorpholin-4-ium-4-yl-propoxy]phenyl]methyl]azanium Openeye Name: [2-[(2S)-2-hydroxy-3-thiomorpholin-4-ium-4-yl-propoxy]phenyl]methyl-[2-(1H-indol-3-yl)ethyl]ammonium CAS Name: [2-[(2S)-2-hydroxy-3-(4-thiomorpholin-4-iumyl)propoxy]phenyl]methyl-[2-(1H-indol-3-yl)ethyl]ammonium IUPAC Name: [2-[(2S)-2-hydroxy-3-thiomorpholin-4-ium-4-ylpropoxy]phenyl]methyl-[2-(1H-indol-3-yl)ethyl]azanium Traditional Name: [2-[(2S)-2-hydroxy-3-thiomorpholin-4-ium-4-yl-propoxy]benzyl]-[2-(1H-indol-3-yl)ethyl]ammonium Formula: C24H33N3O2S+2 MolecularWeight: 427.60272

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCC[NH+]1CC(COC2=CC=CC=C2C[NH2+]CCC3=CNC4=CC=CC=C43)O

Isomeric SMILES

C1CSCC[NH+]1C[C@@H](COC2=CC=CC=C2C[NH2+]CCC3=CNC4=CC=CC=C43)O

InChI

InChI=1S/C24H31N3O2S/c28-21(17-27-11-13-30-14-12-27)18-29-24-8-4-1-5-20(24)15-25-10-9-19-16-26-23-7-3-2-6-22(19)23/h1-8,16,21,25-26,28H,9-15,17-18H2/p+2/t21-/m0/s1