5-(3-ethyloctan-3-yl)-1H-1,2,4-triazol-3-amine

Systemtic Name: 5-(3-ethyloctan-3-yl)-1H-1,2,4-triazol-3-amine Openeye Name: 5-(1,1-diethylhexyl)-1H-1,2,4-triazol-3-amine CAS Name: 5-(3-ethyloctan-3-yl)-1H-1,2,4-triazol-3-amine IUPAC Name: 5-(3-ethyloctan-3-yl)-1H-1,2,4-triazol-3-amine Traditional Name: [5-(1,1-diethylhexyl)-1H-1,2,4-triazol-3-yl]amine Formula: C12H24N4 MolecularWeight: 224.34576

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC)(CC)C1=NC(=NN1)N

Isomeric SMILES

CCCCCC(CC)(CC)C1=NC(=NN1)N

InChI

InChI=1S/C12H24N4/c1-4-7-8-9-12(5-2,6-3)10-14-11(13)16-15-10/h4-9H2,1-3H3,(H3,13,14,15,16)