2-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-cyclooctyl-ethanamide

Systemtic Name: 2-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-cyclooctyl-ethanamide Openeye Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-N-cyclooctyl-acetamide CAS Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-N-cyclooctylacetamide IUPAC Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-N-cyclooctylacetamide Traditional Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-N-cyclooctyl-acetamide Formula: C12H21N5OS MolecularWeight: 283.39304

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)NC(=O)CSC2=NNC(=N2)N

Isomeric SMILES

C1CCCC(CCC1)NC(=O)CSC2=NNC(=N2)N

InChI

InChI=1S/C12H21N5OS/c13-11-15-12(17-16-11)19-8-10(18)14-9-6-4-2-1-3-5-7-9/h9H,1-8H2,(H,14,18)(H3,13,15,16,17)