[1-[(2-fluorophenyl)carbamothioyl]piperidin-4-yl]-methyl-(3-methylbutyl)azanium

Systemtic Name: [1-[(2-fluorophenyl)carbamothioyl]piperidin-4-yl]-methyl-(3-methylbutyl)azanium Openeye Name: [1-[(2-fluorophenyl)carbamothioyl]-4-piperidyl]-isopentyl-methyl-ammonium CAS Name: [1-[(2-fluoroanilino)-sulfanylidenemethyl]-4-piperidinyl]-methyl-(3-methylbutyl)ammonium IUPAC Name: [1-[(2-fluorophenyl)carbamothioyl]piperidin-4-yl]-methyl-(3-methylbutyl)azanium Traditional Name: [1-[(2-fluorophenyl)thiocarbamoyl]-4-piperidyl]-isoamyl-methyl-ammonium Formula: C18H29FN3S+ MolecularWeight: 338.506363

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC[NH+](C)C1CCN(CC1)C(=S)NC2=CC=CC=C2F

Isomeric SMILES

CC(C)CC[NH+](C)C1CCN(CC1)C(=S)NC2=CC=CC=C2F

InChI

InChI=1S/C18H28FN3S/c1-14(2)8-11-21(3)15-9-12-22(13-10-15)18(23)20-17-7-5-4-6-16(17)19/h4-7,14-15H,8-13H2,1-3H3,(H,20,23)/p+1