(4-bromophenyl)methyl-ethyl-[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl]azanium

Systemtic Name: (4-bromophenyl)methyl-ethyl-[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl]azanium Openeye Name: (4-bromophenyl)methyl-ethyl-[2-oxo-2-(2-thienylmethylamino)ethyl]ammonium CAS Name: (4-bromophenyl)methyl-ethyl-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]ammonium IUPAC Name: (4-bromophenyl)methyl-ethyl-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]azanium Traditional Name: (4-bromobenzyl)-ethyl-[2-keto-2-(2-thenylamino)ethyl]ammonium Formula: C16H20BrN2OS+ MolecularWeight: 368.3118

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC=C(C=C1)Br)CC(=O)NCC2=CC=CS2

Isomeric SMILES

CC[NH+](CC1=CC=C(C=C1)Br)CC(=O)NCC2=CC=CS2

InChI

InChI=1S/C16H19BrN2OS/c1-2-19(11-13-5-7-14(17)8-6-13)12-16(20)18-10-15-4-3-9-21-15/h3-9H,2,10-12H2,1H3,(H,18,20)/p+1