1-(5-bromanylthiophen-2-yl)-N-[4-[(2-chlorophenyl)methyl]piperazin-4-ium-1-yl]methanimine

Systemtic Name: 1-(5-bromanylthiophen-2-yl)-N-[4-[(2-chlorophenyl)methyl]piperazin-4-ium-1-yl]methanimine Openeye Name: 1-(5-bromo-2-thienyl)-N-[4-[(2-chlorophenyl)methyl]piperazin-4-ium-1-yl]methanimine CAS Name: 1-(5-bromo-2-thiophenyl)-N-[4-[(2-chlorophenyl)methyl]-1-piperazin-4-iumyl]methanimine IUPAC Name: 1-(5-bromothiophen-2-yl)-N-[4-[(2-chlorophenyl)methyl]piperazin-4-ium-1-yl]methanimine Traditional Name: (Z)-(5-bromo-2-thienyl)methylene-[4-(2-chlorobenzyl)piperazin-4-ium-1-yl]amine Formula: C16H18BrClN3S+ MolecularWeight: 399.75622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=C2Cl)N=CC3=CC=C(S3)Br

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=C2Cl)/N=C\C3=CC=C(S3)Br

InChI

InChI=1S/C16H17BrClN3S/c17-16-6-5-14(22-16)11-19-21-9-7-20(8-10-21)12-13-3-1-2-4-15(13)18/h1-6,11H,7-10,12H2/p+1/b19-11-