5-(3,5-dimethoxyphenyl)-1-ethyl-1,2,4-triazolidine-3-thione

Systemtic Name: 5-(3,5-dimethoxyphenyl)-1-ethyl-1,2,4-triazolidine-3-thione Openeye Name: 5-(3,5-dimethoxyphenyl)-1-ethyl-1,2,4-triazolidine-3-thione CAS Name: 5-(3,5-dimethoxyphenyl)-1-ethyl-1,2,4-triazolidine-3-thione IUPAC Name: 5-(3,5-dimethoxyphenyl)-1-ethyl-1,2,4-triazolidine-3-thione Traditional Name: 5-(3,5-dimethoxyphenyl)-1-ethyl-1,2,4-triazolidine-3-thione Formula: C12H17N3O2S MolecularWeight: 267.34728

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(NC(=S)N1)C2=CC(=CC(=C2)OC)OC

Isomeric SMILES

CCN1C(NC(=S)N1)C2=CC(=CC(=C2)OC)OC

InChI

InChI=1S/C12H17N3O2S/c1-4-15-11(13-12(18)14-15)8-5-9(16-2)7-10(6-8)17-3/h5-7,11H,4H2,1-3H3,(H2,13,14,18)