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

Systemtic Name: 5-butyl-1-(2-ethoxyphenyl)-1,3,5-triazinan-5-ium-2-thione Openeye Name: 5-butyl-1-(2-ethoxyphenyl)-1,3,5-triazinan-5-ium-2-thione CAS Name: 5-butyl-1-(2-ethoxyphenyl)-1,3,5-triazinan-5-ium-2-thione IUPAC Name: 5-butyl-1-(2-ethoxyphenyl)-1,3,5-triazinan-5-ium-2-thione Traditional Name: 5-butyl-1-o-phenetyl-1,3,5-triazinan-5-ium-2-thione Formula: C15H24N3OS+ MolecularWeight: 294.43556

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+]1CNC(=S)N(C1)C2=CC=CC=C2OCC

Isomeric SMILES

CCCC[NH+]1CNC(=S)N(C1)C2=CC=CC=C2OCC

InChI

InChI=1S/C15H23N3OS/c1-3-5-10-17-11-16-15(20)18(12-17)13-8-6-7-9-14(13)19-4-2/h6-9H,3-5,10-12H2,1-2H3,(H,16,20)/p+1