methyl-propan-2-yl-[1-[[3-(trifluoromethyl)phenyl]carbamothioyl]piperidin-4-yl]azanium

Systemtic Name: methyl-propan-2-yl-[1-[[3-(trifluoromethyl)phenyl]carbamothioyl]piperidin-4-yl]azanium Openeye Name: isopropyl-methyl-[1-[[3-(trifluoromethyl)phenyl]carbamothioyl]-4-piperidyl]ammonium CAS Name: methyl-propan-2-yl-[1-[sulfanylidene-[3-(trifluoromethyl)anilino]methyl]-4-piperidinyl]ammonium IUPAC Name: methyl-propan-2-yl-[1-[[3-(trifluoromethyl)phenyl]carbamothioyl]piperidin-4-yl]azanium Traditional Name: isopropyl-methyl-[1-[[3-(trifluoromethyl)phenyl]thiocarbamoyl]-4-piperidyl]ammonium Formula: C17H25F3N3S+ MolecularWeight: 360.46071

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+](C)C1CCN(CC1)C(=S)NC2=CC=CC(=C2)C(F)(F)F

Isomeric SMILES

CC(C)[NH+](C)C1CCN(CC1)C(=S)NC2=CC=CC(=C2)C(F)(F)F

InChI

InChI=1S/C17H24F3N3S/c1-12(2)22(3)15-7-9-23(10-8-15)16(24)21-14-6-4-5-13(11-14)17(18,19)20/h4-6,11-12,15H,7-10H2,1-3H3,(H,21,24)/p+1