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

Systemtic Name: 1-(phenylmethyl)-5-propyl-1,3,5-triazinan-5-ium-2-thione Openeye Name: 1-benzyl-5-propyl-1,3,5-triazinan-5-ium-2-thione CAS Name: 1-(phenylmethyl)-5-propyl-1,3,5-triazinan-5-ium-2-thione IUPAC Name: 1-benzyl-5-propyl-1,3,5-triazinan-5-ium-2-thione Traditional Name: 1-benzyl-5-propyl-1,3,5-triazinan-5-ium-2-thione Formula: C13H20N3S+ MolecularWeight: 250.383

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CNC(=S)N(C1)CC2=CC=CC=C2

Isomeric SMILES

CCC[NH+]1CNC(=S)N(C1)CC2=CC=CC=C2

InChI

InChI=1S/C13H19N3S/c1-2-8-15-10-14-13(17)16(11-15)9-12-6-4-3-5-7-12/h3-7H,2,8-11H2,1H3,(H,14,17)/p+1