[(2S)-4-methylsulfanyl-1-oxidanylidene-1-(phenethylamino)butan-2-yl]azanium

Systemtic Name: [(2S)-4-methylsulfanyl-1-oxidanylidene-1-(phenethylamino)butan-2-yl]azanium Openeye Name: [(1S)-3-methylsulfanyl-1-(phenethylcarbamoyl)propyl]ammonium CAS Name: [(2S)-4-(methylthio)-1-oxo-1-(phenethylamino)butan-2-yl]ammonium IUPAC Name: [(2S)-4-methylsulfanyl-1-oxo-1-(phenethylamino)butan-2-yl]azanium Traditional Name: [(1S)-3-(methylthio)-1-(phenethylcarbamoyl)propyl]ammonium Formula: C13H21N2OS+ MolecularWeight: 253.38364

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NCCC1=CC=CC=C1)[NH3+]

Isomeric SMILES

CSCC[C@@H](C(=O)NCCC1=CC=CC=C1)[NH3+]

InChI

InChI=1S/C13H20N2OS/c1-17-10-8-12(14)13(16)15-9-7-11-5-3-2-4-6-11/h2-6,12H,7-10,14H2,1H3,(H,15,16)/p+1/t12-/m0/s1