(5-bromanylthiophen-2-yl)methyl-methyl-[(2S)-1-oxidanylidene-1-(propan-2-ylamino)propan-2-yl]azanium

Systemtic Name: (5-bromanylthiophen-2-yl)methyl-methyl-[(2S)-1-oxidanylidene-1-(propan-2-ylamino)propan-2-yl]azanium Openeye Name: (5-bromo-2-thienyl)methyl-[(1S)-2-(isopropylamino)-1-methyl-2-oxo-ethyl]-methyl-ammonium CAS Name: (5-bromo-2-thiophenyl)methyl-methyl-[(2S)-1-oxo-1-(propan-2-ylamino)propan-2-yl]ammonium IUPAC Name: (5-bromothiophen-2-yl)methyl-methyl-[(2S)-1-oxo-1-(propan-2-ylamino)propan-2-yl]azanium Traditional Name: (5-bromo-2-thienyl)methyl-[(1S)-2-(isopropylamino)-2-keto-1-methyl-ethyl]-methyl-ammonium Formula: C12H20BrN2OS+ MolecularWeight: 320.269

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C(C)[NH+](C)CC1=CC=C(S1)Br

Isomeric SMILES

C[C@@H](C(=O)NC(C)C)[NH+](C)CC1=CC=C(S1)Br

InChI

InChI=1S/C12H19BrN2OS/c1-8(2)14-12(16)9(3)15(4)7-10-5-6-11(13)17-10/h5-6,8-9H,7H2,1-4H3,(H,14,16)/p+1/t9-/m0/s1