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

Systemtic Name: 1-(3-methoxypropyl)-5-(phenylmethyl)-1,3,5-triazinan-5-ium-2-thione Openeye Name: 5-benzyl-1-(3-methoxypropyl)-1,3,5-triazinan-5-ium-2-thione CAS Name: 1-(3-methoxypropyl)-5-(phenylmethyl)-1,3,5-triazinan-5-ium-2-thione IUPAC Name: 5-benzyl-1-(3-methoxypropyl)-1,3,5-triazinan-5-ium-2-thione Traditional Name: 5-benzyl-1-(3-methoxypropyl)-1,3,5-triazinan-5-ium-2-thione Formula: C14H22N3OS+ MolecularWeight: 280.40898

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C[NH+](CNC1=S)CC2=CC=CC=C2

Isomeric SMILES

COCCCN1C[NH+](CNC1=S)CC2=CC=CC=C2

InChI

InChI=1S/C14H21N3OS/c1-18-9-5-8-17-12-16(11-15-14(17)19)10-13-6-3-2-4-7-13/h2-4,6-7H,5,8-12H2,1H3,(H,15,19)/p+1