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

Systemtic Name: 5-[(2-chlorophenyl)methyl]-1-phenethyl-1,3,5-triazinan-5-ium-2-thione Openeye Name: 5-[(2-chlorophenyl)methyl]-1-phenethyl-1,3,5-triazinan-5-ium-2-thione CAS Name: 5-[(2-chlorophenyl)methyl]-1-phenethyl-1,3,5-triazinan-5-ium-2-thione IUPAC Name: 5-[(2-chlorophenyl)methyl]-1-phenethyl-1,3,5-triazinan-5-ium-2-thione Traditional Name: 5-(2-chlorobenzyl)-1-phenethyl-1,3,5-triazinan-5-ium-2-thione Formula: C18H21ClN3S+ MolecularWeight: 346.89744

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Descriptors Computed from Structure

Canonical SMILES:

C1NC(=S)N(C[NH+]1CC2=CC=CC=C2Cl)CCC3=CC=CC=C3

Isomeric SMILES

C1NC(=S)N(C[NH+]1CC2=CC=CC=C2Cl)CCC3=CC=CC=C3

InChI

InChI=1S/C18H20ClN3S/c19-17-9-5-4-8-16(17)12-21-13-20-18(23)22(14-21)11-10-15-6-2-1-3-7-15/h1-9H,10-14H2,(H,20,23)/p+1