[(2S)-1-(2-methyl-4,5-dihydro-1H-imidazol-3-ium-3-yl)-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]azanium

Systemtic Name: [(2S)-1-(2-methyl-4,5-dihydro-1H-imidazol-3-ium-3-yl)-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]azanium Openeye Name: [(1S)-1-(2-methyl-4,5-dihydro-1H-imidazol-3-ium-3-carbonyl)-3-methylsulfanyl-propyl]ammonium CAS Name: [(2S)-1-(2-methyl-4,5-dihydro-1H-imidazol-3-ium-3-yl)-4-(methylthio)-1-oxobutan-2-yl]ammonium IUPAC Name: [(2S)-1-(2-methyl-4,5-dihydro-1H-imidazol-3-ium-3-yl)-4-methylsulfanyl-1-oxobutan-2-yl]azanium Traditional Name: [(1S)-1-(2-methyl-2-imidazolin-1-ium-1-carbonyl)-3-(methylthio)propyl]ammonium Formula: C9H19N3OS+2 MolecularWeight: 217.33166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](CCN1)C(=O)C(CCSC)[NH3+]

Isomeric SMILES

CC1=[N+](CCN1)C(=O)[C@H](CCSC)[NH3+]

InChI

InChI=1S/C9H17N3OS/c1-7-11-4-5-12(7)9(13)8(10)3-6-14-2/h8H,3-6,10H2,1-2H3/p+2/t8-/m0/s1