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

Systemtic Name: 5-phenethyl-1-phenyl-1,3,5-triazinan-5-ium-2-thione Openeye Name: 5-phenethyl-1-phenyl-1,3,5-triazinan-5-ium-2-thione CAS Name: 5-phenethyl-1-phenyl-1,3,5-triazinan-5-ium-2-thione IUPAC Name: 5-phenethyl-1-phenyl-1,3,5-triazinan-5-ium-2-thione Traditional Name: 5-phenethyl-1-phenyl-1,3,5-triazinan-5-ium-2-thione Formula: C17H20N3S+ MolecularWeight: 298.4258

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Descriptors Computed from Structure

Canonical SMILES:

C1NC(=S)N(C[NH+]1CCC2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

C1NC(=S)N(C[NH+]1CCC2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C17H19N3S/c21-17-18-13-19(12-11-15-7-3-1-4-8-15)14-20(17)16-9-5-2-6-10-16/h1-10H,11-14H2,(H,18,21)/p+1