1-phenethyl-5-propyl-1,3,5-triazinan-5-ium-2-thione

Systemtic Name: 1-phenethyl-5-propyl-1,3,5-triazinan-5-ium-2-thione Openeye Name: 1-phenethyl-5-propyl-1,3,5-triazinan-5-ium-2-thione CAS Name: 1-phenethyl-5-propyl-1,3,5-triazinan-5-ium-2-thione IUPAC Name: 1-phenethyl-5-propyl-1,3,5-triazinan-5-ium-2-thione Traditional Name: 1-phenethyl-5-propyl-1,3,5-triazinan-5-ium-2-thione Formula: C14H22N3S+ MolecularWeight: 264.40958

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CNC(=S)N(C1)CCC2=CC=CC=C2

Isomeric SMILES

CCC[NH+]1CNC(=S)N(C1)CCC2=CC=CC=C2

InChI

InChI=1S/C14H21N3S/c1-2-9-16-11-15-14(18)17(12-16)10-8-13-6-4-3-5-7-13/h3-7H,2,8-12H2,1H3,(H,15,18)/p+1