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

Systemtic Name: 5-butyl-1-(4-methylphenyl)-1,3,5-triazinan-5-ium-2-thione Openeye Name: 5-butyl-1-(p-tolyl)-1,3,5-triazinan-5-ium-2-thione CAS Name: 5-butyl-1-(4-methylphenyl)-1,3,5-triazinan-5-ium-2-thione IUPAC Name: 5-butyl-1-(4-methylphenyl)-1,3,5-triazinan-5-ium-2-thione Traditional Name: 5-butyl-1-(p-tolyl)-1,3,5-triazinan-5-ium-2-thione Formula: C14H22N3S+ MolecularWeight: 264.40958

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21N3S/c1-3-4-9-16-10-15-14(18)17(11-16)13-7-5-12(2)6-8-13/h5-8H,3-4,9-11H2,1-2H3,(H,15,18)/p+1