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

Systemtic Name: 1-butyl-5-[(4-methoxyphenyl)methyl]-1,3,5-triazinan-5-ium-2-thione Openeye Name: 1-butyl-5-[(4-methoxyphenyl)methyl]-1,3,5-triazinan-5-ium-2-thione CAS Name: 1-butyl-5-[(4-methoxyphenyl)methyl]-1,3,5-triazinan-5-ium-2-thione IUPAC Name: 1-butyl-5-[(4-methoxyphenyl)methyl]-1,3,5-triazinan-5-ium-2-thione Traditional Name: 1-butyl-5-p-anisyl-1,3,5-triazinan-5-ium-2-thione Formula: C15H24N3OS+ MolecularWeight: 294.43556

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C[NH+](CNC1=S)CC2=CC=C(C=C2)OC

Isomeric SMILES

CCCCN1C[NH+](CNC1=S)CC2=CC=C(C=C2)OC

InChI

InChI=1S/C15H23N3OS/c1-3-4-9-18-12-17(11-16-15(18)20)10-13-5-7-14(19-2)8-6-13/h5-8H,3-4,9-12H2,1-2H3,(H,16,20)/p+1