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

Systemtic Name: 5-(furan-2-ylmethyl)-1-(3-methoxypropyl)-1,3,5-triazinan-5-ium-2-thione Openeye Name: 5-(2-furylmethyl)-1-(3-methoxypropyl)-1,3,5-triazinan-5-ium-2-thione CAS Name: 5-(2-furanylmethyl)-1-(3-methoxypropyl)-1,3,5-triazinan-5-ium-2-thione IUPAC Name: 5-(furan-2-ylmethyl)-1-(3-methoxypropyl)-1,3,5-triazinan-5-ium-2-thione Traditional Name: 5-(2-furfuryl)-1-(3-methoxypropyl)-1,3,5-triazinan-5-ium-2-thione Formula: C12H20N3O2S+ MolecularWeight: 270.3711

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C[NH+](CNC1=S)CC2=CC=CO2

Isomeric SMILES

COCCCN1C[NH+](CNC1=S)CC2=CC=CO2

InChI

InChI=1S/C12H19N3O2S/c1-16-6-3-5-15-10-14(9-13-12(15)18)8-11-4-2-7-17-11/h2,4,7H,3,5-6,8-10H2,1H3,(H,13,18)/p+1