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

Systemtic Name: 1-(3-ethoxypropyl)-5-(furan-2-ylmethyl)-1,3,5-triazinan-5-ium-2-thione Openeye Name: 1-(3-ethoxypropyl)-5-(2-furylmethyl)-1,3,5-triazinan-5-ium-2-thione CAS Name: 1-(3-ethoxypropyl)-5-(2-furanylmethyl)-1,3,5-triazinan-5-ium-2-thione IUPAC Name: 1-(3-ethoxypropyl)-5-(furan-2-ylmethyl)-1,3,5-triazinan-5-ium-2-thione Traditional Name: 1-(3-ethoxypropyl)-5-(2-furfuryl)-1,3,5-triazinan-5-ium-2-thione Formula: C13H22N3O2S+ MolecularWeight: 284.39768

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCN1C[NH+](CNC1=S)CC2=CC=CO2

Isomeric SMILES

CCOCCCN1C[NH+](CNC1=S)CC2=CC=CO2

InChI

InChI=1S/C13H21N3O2S/c1-2-17-7-4-6-16-11-15(10-14-13(16)19)9-12-5-3-8-18-12/h3,5,8H,2,4,6-7,9-11H2,1H3,(H,14,19)/p+1