[(1S)-1-(4-methylsulfanylphenyl)ethyl]-(3-oxidanylidene-3-pyrrolidin-1-yl-propyl)azanium

Systemtic Name: [(1S)-1-(4-methylsulfanylphenyl)ethyl]-(3-oxidanylidene-3-pyrrolidin-1-yl-propyl)azanium Openeye Name: [(1S)-1-(4-methylsulfanylphenyl)ethyl]-(3-oxo-3-pyrrolidin-1-yl-propyl)ammonium CAS Name: [(1S)-1-[4-(methylthio)phenyl]ethyl]-[3-oxo-3-(1-pyrrolidinyl)propyl]ammonium IUPAC Name: [(1S)-1-(4-methylsulfanylphenyl)ethyl]-(3-oxo-3-pyrrolidin-1-ylpropyl)azanium Traditional Name: (3-keto-3-pyrrolidino-propyl)-[(1S)-1-[4-(methylthio)phenyl]ethyl]ammonium Formula: C16H25N2OS+ MolecularWeight: 293.4475

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)SC)[NH2+]CCC(=O)N2CCCC2

Isomeric SMILES

C[C@@H](C1=CC=C(C=C1)SC)[NH2+]CCC(=O)N2CCCC2

InChI

InChI=1S/C16H24N2OS/c1-13(14-5-7-15(20-2)8-6-14)17-10-9-16(19)18-11-3-4-12-18/h5-8,13,17H,3-4,9-12H2,1-2H3/p+1/t13-/m0/s1