[(2S)-1-[(2-methyl-6-propan-2-yl-phenyl)amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]azanium

Systemtic Name: [(2S)-1-[(2-methyl-6-propan-2-yl-phenyl)amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]azanium Openeye Name: [(1S)-1-[(2-isopropyl-6-methyl-phenyl)carbamoyl]-3-methylsulfanyl-propyl]ammonium CAS Name: [(2S)-1-(2-methyl-6-propan-2-ylanilino)-4-(methylthio)-1-oxobutan-2-yl]ammonium IUPAC Name: [(2S)-1-(2-methyl-6-propan-2-ylanilino)-4-methylsulfanyl-1-oxobutan-2-yl]azanium Traditional Name: [(1S)-1-[(2-isopropyl-6-methyl-phenyl)carbamoyl]-3-(methylthio)propyl]ammonium Formula: C15H25N2OS+ MolecularWeight: 281.4368

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H24N2OS/c1-10(2)12-7-5-6-11(3)14(12)17-15(18)13(16)8-9-19-4/h5-7,10,13H,8-9,16H2,1-4H3,(H,17,18)/p+1/t13-/m0/s1