[(2S)-4-methylsulfanyl-1-oxidanylidene-1-[(phenylmethyl)-propan-2-yl-amino]butan-2-yl]azanium

Systemtic Name: [(2S)-4-methylsulfanyl-1-oxidanylidene-1-[(phenylmethyl)-propan-2-yl-amino]butan-2-yl]azanium Openeye Name: [(1S)-1-[benzyl(isopropyl)carbamoyl]-3-methylsulfanyl-propyl]ammonium CAS Name: [(2S)-4-(methylthio)-1-oxo-1-[(phenylmethyl)-propan-2-ylamino]butan-2-yl]ammonium IUPAC Name: [(2S)-1-[benzyl(propan-2-yl)amino]-4-methylsulfanyl-1-oxobutan-2-yl]azanium Traditional Name: [(1S)-1-[benzyl(isopropyl)carbamoyl]-3-(methylthio)propyl]ammonium Formula: C15H25N2OS+ MolecularWeight: 281.4368

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC1=CC=CC=C1)C(=O)C(CCSC)[NH3+]

Isomeric SMILES

CC(C)N(CC1=CC=CC=C1)C(=O)[C@H](CCSC)[NH3+]

InChI

InChI=1S/C15H24N2OS/c1-12(2)17(11-13-7-5-4-6-8-13)15(18)14(16)9-10-19-3/h4-8,12,14H,9-11,16H2,1-3H3/p+1/t14-/m0/s1