[(2-chloranylcyclohexyl)sulfanyl-(2-fluorophenyl)carbamoyl]-dimethyl-propyl-azanium

Systemtic Name: [(2-chloranylcyclohexyl)sulfanyl-(2-fluorophenyl)carbamoyl]-dimethyl-propyl-azanium Openeye Name: [(2-chlorocyclohexyl)sulfanyl-(2-fluorophenyl)carbamoyl]-dimethyl-propyl-ammonium CAS Name: [(N-[(2-chlorocyclohexyl)thio]-2-fluoroanilino)-oxomethyl]-dimethyl-propylammonium IUPAC Name: [(2-chlorocyclohexyl)sulfanyl-(2-fluorophenyl)carbamoyl]-dimethyl-propylazanium Traditional Name: [[(2-chlorocyclohexyl)thio]-(2-fluorophenyl)carbamoyl]-dimethyl-propyl-ammonium Formula: C18H27ClFN2OS+ MolecularWeight: 373.936183

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC[N+](C)(C)C(=O)N(C1=CC=CC=C1F)SC2CCCCC2Cl

Isomeric SMILES

CCC[N+](C)(C)C(=O)N(C1=CC=CC=C1F)SC2CCCCC2Cl

InChI

InChI=1S/C18H27ClFN2OS/c1-4-13-22(2,3)18(23)21(16-11-7-6-10-15(16)20)24-17-12-8-5-9-14(17)19/h6-7,10-11,14,17H,4-5,8-9,12-13H2,1-3H3/q+1