1-(3-chlorophenyl)-5-phenethyl-1,3,5-triazinan-5-ium-2-thione

Systemtic Name: 1-(3-chlorophenyl)-5-phenethyl-1,3,5-triazinan-5-ium-2-thione Openeye Name: 1-(3-chlorophenyl)-5-phenethyl-1,3,5-triazinan-5-ium-2-thione CAS Name: 1-(3-chlorophenyl)-5-phenethyl-1,3,5-triazinan-5-ium-2-thione IUPAC Name: 1-(3-chlorophenyl)-5-phenethyl-1,3,5-triazinan-5-ium-2-thione Traditional Name: 1-(3-chlorophenyl)-5-phenethyl-1,3,5-triazinan-5-ium-2-thione Formula: C17H19ClN3S+ MolecularWeight: 332.87086

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18ClN3S/c18-15-7-4-8-16(11-15)21-13-20(12-19-17(21)22)10-9-14-5-2-1-3-6-14/h1-8,11H,9-10,12-13H2,(H,19,22)/p+1