5-phenethyl-N-(2-propan-2-ylphenyl)-1H-1,2,4-triazol-3-amine

Systemtic Name: 5-phenethyl-N-(2-propan-2-ylphenyl)-1H-1,2,4-triazol-3-amine Openeye Name: N-(2-isopropylphenyl)-5-phenethyl-1H-1,2,4-triazol-3-amine CAS Name: 5-phenethyl-N-(2-propan-2-ylphenyl)-1H-1,2,4-triazol-3-amine IUPAC Name: 5-phenethyl-N-(2-propan-2-ylphenyl)-1H-1,2,4-triazol-3-amine Traditional Name: o-cumenyl-(5-phenethyl-1H-1,2,4-triazol-3-yl)amine Formula: C19H22N4 MolecularWeight: 306.40478

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1NC2=NNC(=N2)CCC3=CC=CC=C3

Isomeric SMILES

CC(C)C1=CC=CC=C1NC2=NNC(=N2)CCC3=CC=CC=C3

InChI

InChI=1S/C19H22N4/c1-14(2)16-10-6-7-11-17(16)20-19-21-18(22-23-19)13-12-15-8-4-3-5-9-15/h3-11,14H,12-13H2,1-2H3,(H2,20,21,22,23)