5-butyl-2,5-dimethyl-1,2,4-triazolidine-3-thione

Systemtic Name: 5-butyl-2,5-dimethyl-1,2,4-triazolidine-3-thione Openeye Name: 5-butyl-2,5-dimethyl-1,2,4-triazolidine-3-thione CAS Name: 5-butyl-2,5-dimethyl-1,2,4-triazolidine-3-thione IUPAC Name: 5-butyl-2,5-dimethyl-1,2,4-triazolidine-3-thione Traditional Name: 5-butyl-2,5-dimethyl-1,2,4-triazolidine-3-thione Formula: C8H17N3S MolecularWeight: 187.30568

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(NC(=S)N(N1)C)C

Isomeric SMILES

CCCCC1(NC(=S)N(N1)C)C

InChI

InChI=1S/C8H17N3S/c1-4-5-6-8(2)9-7(12)11(3)10-8/h10H,4-6H2,1-3H3,(H,9,12)