2-(4-butyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-N-methyl-ethanamide

Systemtic Name: 2-(4-butyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-N-methyl-ethanamide Openeye Name: 2-(4-butyl-5-thioxo-1H-1,2,4-triazol-3-yl)-N-methyl-acetamide CAS Name: 2-(4-butyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-N-methylacetamide IUPAC Name: 2-(4-butyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-N-methylacetamide Traditional Name: 2-(4-butyl-5-thioxo-1H-1,2,4-triazol-3-yl)-N-methyl-acetamide Formula: C9H16N4OS MolecularWeight: 228.31454

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=NNC1=S)CC(=O)NC

Isomeric SMILES

CCCCN1C(=NNC1=S)CC(=O)NC

InChI

InChI=1S/C9H16N4OS/c1-3-4-5-13-7(6-8(14)10-2)11-12-9(13)15/h3-6H2,1-2H3,(H,10,14)(H,12,15)