1-(4-fluorophenyl)-5-[(4-methoxyphenyl)methyl]-1,3,5-triazinan-5-ium-2-thione

Systemtic Name: 1-(4-fluorophenyl)-5-[(4-methoxyphenyl)methyl]-1,3,5-triazinan-5-ium-2-thione Openeye Name: 1-(4-fluorophenyl)-5-[(4-methoxyphenyl)methyl]-1,3,5-triazinan-5-ium-2-thione CAS Name: 1-(4-fluorophenyl)-5-[(4-methoxyphenyl)methyl]-1,3,5-triazinan-5-ium-2-thione IUPAC Name: 1-(4-fluorophenyl)-5-[(4-methoxyphenyl)methyl]-1,3,5-triazinan-5-ium-2-thione Traditional Name: 1-(4-fluorophenyl)-5-p-anisyl-1,3,5-triazinan-5-ium-2-thione Formula: C17H19FN3OS+ MolecularWeight: 332.415663

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C[NH+]2CNC(=S)N(C2)C3=CC=C(C=C3)F

Isomeric SMILES

COC1=CC=C(C=C1)C[NH+]2CNC(=S)N(C2)C3=CC=C(C=C3)F

InChI

InChI=1S/C17H18FN3OS/c1-22-16-8-2-13(3-9-16)10-20-11-19-17(23)21(12-20)15-6-4-14(18)5-7-15/h2-9H,10-12H2,1H3,(H,19,23)/p+1