5-butyl-1-(4-fluorophenyl)-1,3,5-triazinan-5-ium-2-thione

Systemtic Name: 5-butyl-1-(4-fluorophenyl)-1,3,5-triazinan-5-ium-2-thione Openeye Name: 5-butyl-1-(4-fluorophenyl)-1,3,5-triazinan-5-ium-2-thione CAS Name: 5-butyl-1-(4-fluorophenyl)-1,3,5-triazinan-5-ium-2-thione IUPAC Name: 5-butyl-1-(4-fluorophenyl)-1,3,5-triazinan-5-ium-2-thione Traditional Name: 5-butyl-1-(4-fluorophenyl)-1,3,5-triazinan-5-ium-2-thione Formula: C13H19FN3S+ MolecularWeight: 268.373463

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+]1CNC(=S)N(C1)C2=CC=C(C=C2)F

Isomeric SMILES

CCCC[NH+]1CNC(=S)N(C1)C2=CC=C(C=C2)F

InChI

InChI=1S/C13H18FN3S/c1-2-3-8-16-9-15-13(18)17(10-16)12-6-4-11(14)5-7-12/h4-7H,2-3,8-10H2,1H3,(H,15,18)/p+1