[(1S)-2-[(4-fluorophenyl)carbamothioylamino]-1-(2-methoxyphenyl)ethyl]-dimethyl-azanium

Systemtic Name: [(1S)-2-[(4-fluorophenyl)carbamothioylamino]-1-(2-methoxyphenyl)ethyl]-dimethyl-azanium Openeye Name: [(1S)-2-[(4-fluorophenyl)carbamothioylamino]-1-(2-methoxyphenyl)ethyl]-dimethyl-ammonium CAS Name: [(1S)-2-[[(4-fluoroanilino)-sulfanylidenemethyl]amino]-1-(2-methoxyphenyl)ethyl]-dimethylammonium IUPAC Name: [(1S)-2-[(4-fluorophenyl)carbamothioylamino]-1-(2-methoxyphenyl)ethyl]-dimethylazanium Traditional Name: [(1S)-2-[(4-fluorophenyl)thiocarbamoylamino]-1-(2-methoxyphenyl)ethyl]-dimethyl-ammonium Formula: C18H23FN3OS+ MolecularWeight: 348.458123

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C(CNC(=S)NC1=CC=C(C=C1)F)C2=CC=CC=C2OC

Isomeric SMILES

C[NH+](C)[C@H](CNC(=S)NC1=CC=C(C=C1)F)C2=CC=CC=C2OC

InChI

InChI=1S/C18H22FN3OS/c1-22(2)16(15-6-4-5-7-17(15)23-3)12-20-18(24)21-14-10-8-13(19)9-11-14/h4-11,16H,12H2,1-3H3,(H2,20,21,24)/p+1/t16-/m1/s1