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

Systemtic Name: 1-(oxolan-2-ylmethyl)-5-(phenylmethyl)-1,3,5-triazinan-5-ium-2-thione Openeye Name: 5-benzyl-1-(tetrahydrofuran-2-ylmethyl)-1,3,5-triazinan-5-ium-2-thione CAS Name: 1-(2-oxolanylmethyl)-5-(phenylmethyl)-1,3,5-triazinan-5-ium-2-thione IUPAC Name: 5-benzyl-1-(oxolan-2-ylmethyl)-1,3,5-triazinan-5-ium-2-thione Traditional Name: 5-benzyl-1-(tetrahydrofurfuryl)-1,3,5-triazinan-5-ium-2-thione Formula: C15H22N3OS+ MolecularWeight: 292.41968

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN2C[NH+](CNC2=S)CC3=CC=CC=C3

Isomeric SMILES

C1CC(OC1)CN2C[NH+](CNC2=S)CC3=CC=CC=C3

InChI

InChI=1S/C15H21N3OS/c20-15-16-11-17(9-13-5-2-1-3-6-13)12-18(15)10-14-7-4-8-19-14/h1-3,5-6,14H,4,7-12H2,(H,16,20)/p+1