N3-[(2,4,6-trimethylphenyl)methyl]-1H-1,2,4-triazole-3,5-diamine

Systemtic Name: N3-[(2,4,6-trimethylphenyl)methyl]-1H-1,2,4-triazole-3,5-diamine Openeye Name: N3-[(2,4,6-trimethylphenyl)methyl]-1H-1,2,4-triazole-3,5-diamine CAS Name: N3-[(2,4,6-trimethylphenyl)methyl]-1H-1,2,4-triazole-3,5-diamine IUPAC Name: 3-N-[(2,4,6-trimethylphenyl)methyl]-1H-1,2,4-triazole-3,5-diamine Traditional Name: (5-amino-1H-1,2,4-triazol-3-yl)-(2,4,6-trimethylbenzyl)amine Formula: C12H17N5 MolecularWeight: 231.29688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)CNC2=NNC(=N2)N)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)CNC2=NNC(=N2)N)C

InChI

InChI=1S/C12H17N5/c1-7-4-8(2)10(9(3)5-7)6-14-12-15-11(13)16-17-12/h4-5H,6H2,1-3H3,(H4,13,14,15,16,17)