[(2S)-3-(6-bromanyl-2-methyl-quinolin-4-yl)sulfanyl-1-methoxy-1-oxidanylidene-propan-2-yl]azanium

Systemtic Name: [(2S)-3-(6-bromanyl-2-methyl-quinolin-4-yl)sulfanyl-1-methoxy-1-oxidanylidene-propan-2-yl]azanium Openeye Name: [(1S)-1-[(6-bromo-2-methyl-4-quinolyl)sulfanylmethyl]-2-methoxy-2-oxo-ethyl]ammonium CAS Name: [(2S)-3-[(6-bromo-2-methyl-4-quinolinyl)thio]-1-methoxy-1-oxopropan-2-yl]ammonium IUPAC Name: [(2S)-3-(6-bromo-2-methylquinolin-4-yl)sulfanyl-1-methoxy-1-oxopropan-2-yl]azanium Traditional Name: [(1S)-1-[[(6-bromo-2-methyl-4-quinolyl)thio]methyl]-2-keto-2-methoxy-ethyl]ammonium Formula: C14H16BrN2O2S+ MolecularWeight: 356.25804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)Br)C(=C1)SCC(C(=O)OC)[NH3+]

Isomeric SMILES

CC1=NC2=C(C=C(C=C2)Br)C(=C1)SC[C@H](C(=O)OC)[NH3+]

InChI

InChI=1S/C14H15BrN2O2S/c1-8-5-13(20-7-11(16)14(18)19-2)10-6-9(15)3-4-12(10)17-8/h3-6,11H,7,16H2,1-2H3/p+1/t11-/m1/s1