5-ethyl-1,4-dimethyl-1,2,4-triazol-4-ium-3-thiolate

Systemtic Name: 5-ethyl-1,4-dimethyl-1,2,4-triazol-4-ium-3-thiolate Openeye Name: 5-ethyl-1,4-dimethyl-1,2,4-triazol-4-ium-3-thiolate CAS Name: 5-ethyl-1,4-dimethyl-1,2,4-triazol-4-ium-3-thiolate IUPAC Name: 5-ethyl-1,4-dimethyl-1,2,4-triazol-4-ium-3-thiolate Traditional Name: 5-ethyl-1,4-dimethyl-1,2,4-triazol-4-ium-3-thiolate Formula: C6H11N3S MolecularWeight: 157.23664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=[N+](C(=NN1C)[S-])C

Isomeric SMILES

CCC1=[N+](C(=NN1C)[S-])C

InChI

InChI=1S/C6H11N3S/c1-4-5-8(2)6(10)7-9(5)3/h4H2,1-3H3