[(1S)-1-(2-chlorophenyl)-2-[(phenylmethyl)carbamothioylamino]ethyl]-dimethyl-azanium

Systemtic Name: [(1S)-1-(2-chlorophenyl)-2-[(phenylmethyl)carbamothioylamino]ethyl]-dimethyl-azanium Openeye Name: [(1S)-2-(benzylcarbamothioylamino)-1-(2-chlorophenyl)ethyl]-dimethyl-ammonium CAS Name: [(1S)-1-(2-chlorophenyl)-2-[[[(phenylmethyl)amino]-sulfanylidenemethyl]amino]ethyl]-dimethylammonium IUPAC Name: [(1S)-2-(benzylcarbamothioylamino)-1-(2-chlorophenyl)ethyl]-dimethylazanium Traditional Name: [(1S)-2-(benzylthiocarbamoylamino)-1-(2-chlorophenyl)ethyl]-dimethyl-ammonium Formula: C18H23ClN3S+ MolecularWeight: 348.91332

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C(CNC(=S)NCC1=CC=CC=C1)C2=CC=CC=C2Cl

Isomeric SMILES

C[NH+](C)[C@H](CNC(=S)NCC1=CC=CC=C1)C2=CC=CC=C2Cl

InChI

InChI=1S/C18H22ClN3S/c1-22(2)17(15-10-6-7-11-16(15)19)13-21-18(23)20-12-14-8-4-3-5-9-14/h3-11,17H,12-13H2,1-2H3,(H2,20,21,23)/p+1/t17-/m1/s1