1-(3-chloranyl-4-fluoranyl-phenyl)-5-cyclohexyl-1,3,5-triazinan-5-ium-2-thione

Systemtic Name: 1-(3-chloranyl-4-fluoranyl-phenyl)-5-cyclohexyl-1,3,5-triazinan-5-ium-2-thione Openeye Name: 1-(3-chloro-4-fluoro-phenyl)-5-cyclohexyl-1,3,5-triazinan-5-ium-2-thione CAS Name: 1-(3-chloro-4-fluorophenyl)-5-cyclohexyl-1,3,5-triazinan-5-ium-2-thione IUPAC Name: 1-(3-chloro-4-fluorophenyl)-5-cyclohexyl-1,3,5-triazinan-5-ium-2-thione Traditional Name: 1-(3-chloro-4-fluoro-phenyl)-5-cyclohexyl-1,3,5-triazinan-5-ium-2-thione Formula: C15H20ClFN3S+ MolecularWeight: 328.855803

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)[NH+]2CNC(=S)N(C2)C3=CC(=C(C=C3)F)Cl

Isomeric SMILES

C1CCC(CC1)[NH+]2CNC(=S)N(C2)C3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C15H19ClFN3S/c16-13-8-12(6-7-14(13)17)20-10-19(9-18-15(20)21)11-4-2-1-3-5-11/h6-8,11H,1-5,9-10H2,(H,18,21)/p+1