1-(4-fluorophenyl)-5-(phenylmethyl)-1,3,5-triazinan-5-ium-2-thione

Systemtic Name: 1-(4-fluorophenyl)-5-(phenylmethyl)-1,3,5-triazinan-5-ium-2-thione Openeye Name: 5-benzyl-1-(4-fluorophenyl)-1,3,5-triazinan-5-ium-2-thione CAS Name: 1-(4-fluorophenyl)-5-(phenylmethyl)-1,3,5-triazinan-5-ium-2-thione IUPAC Name: 5-benzyl-1-(4-fluorophenyl)-1,3,5-triazinan-5-ium-2-thione Traditional Name: 5-benzyl-1-(4-fluorophenyl)-1,3,5-triazinan-5-ium-2-thione Formula: C16H17FN3S+ MolecularWeight: 302.389683

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Descriptors Computed from Structure

Canonical SMILES:

C1NC(=S)N(C[NH+]1CC2=CC=CC=C2)C3=CC=C(C=C3)F

Isomeric SMILES

C1NC(=S)N(C[NH+]1CC2=CC=CC=C2)C3=CC=C(C=C3)F

InChI

InChI=1S/C16H16FN3S/c17-14-6-8-15(9-7-14)20-12-19(11-18-16(20)21)10-13-4-2-1-3-5-13/h1-9H,10-12H2,(H,18,21)/p+1