[(2S)-2-(4-bromanylthiophen-2-yl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]azanium

Systemtic Name: [(2S)-2-(4-bromanylthiophen-2-yl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]azanium Openeye Name: [(2S)-2-(4-bromo-2-thienyl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]ammonium CAS Name: [(2S)-2-(4-bromo-2-thiophenyl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]ammonium IUPAC Name: [(2S)-2-(4-bromothiophen-2-yl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]azanium Traditional Name: [(2S)-2-(4-bromo-2-thienyl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]ammonium Formula: C15H18BrN2S+ MolecularWeight: 338.28582

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(C[NH3+])C3=CC(=CS3)Br

Isomeric SMILES

C1CN(CC2=CC=CC=C21)[C@@H](C[NH3+])C3=CC(=CS3)Br

InChI

InChI=1S/C15H17BrN2S/c16-13-7-15(19-10-13)14(8-17)18-6-5-11-3-1-2-4-12(11)9-18/h1-4,7,10,14H,5-6,8-9,17H2/p+1/t14-/m0/s1