[(1S)-1-(furan-2-yl)-2-[(4-methylsulfanylphenyl)methylamino]ethyl]-dimethyl-azanium

Systemtic Name: [(1S)-1-(furan-2-yl)-2-[(4-methylsulfanylphenyl)methylamino]ethyl]-dimethyl-azanium Openeye Name: [(1S)-1-(2-furyl)-2-[(4-methylsulfanylphenyl)methylamino]ethyl]-dimethyl-ammonium CAS Name: [(1S)-1-(2-furanyl)-2-[[4-(methylthio)phenyl]methylamino]ethyl]-dimethylammonium IUPAC Name: [(1S)-1-(furan-2-yl)-2-[(4-methylsulfanylphenyl)methylamino]ethyl]-dimethylazanium Traditional Name: [(1S)-1-(2-furyl)-2-[[4-(methylthio)benzyl]amino]ethyl]-dimethyl-ammonium Formula: C16H23N2OS+ MolecularWeight: 291.43162

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C(CNCC1=CC=C(C=C1)SC)C2=CC=CO2

Isomeric SMILES

C[NH+](C)[C@@H](CNCC1=CC=C(C=C1)SC)C2=CC=CO2

InChI

InChI=1S/C16H22N2OS/c1-18(2)15(16-5-4-10-19-16)12-17-11-13-6-8-14(20-3)9-7-13/h4-10,15,17H,11-12H2,1-3H3/p+1/t15-/m0/s1