N3-[1-(4-chlorophenyl)ethyl]-1H-1,2,4-triazole-3,5-diamine

Systemtic Name: N3-[1-(4-chlorophenyl)ethyl]-1H-1,2,4-triazole-3,5-diamine Openeye Name: N3-[1-(4-chlorophenyl)ethyl]-1H-1,2,4-triazole-3,5-diamine CAS Name: N3-[1-(4-chlorophenyl)ethyl]-1H-1,2,4-triazole-3,5-diamine IUPAC Name: 3-N-[1-(4-chlorophenyl)ethyl]-1H-1,2,4-triazole-3,5-diamine Traditional Name: (5-amino-1H-1,2,4-triazol-3-yl)-[1-(4-chlorophenyl)ethyl]amine Formula: C10H12ClN5 MolecularWeight: 237.68878

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)Cl)NC2=NNC(=N2)N

Isomeric SMILES

CC(C1=CC=C(C=C1)Cl)NC2=NNC(=N2)N

InChI

InChI=1S/C10H12ClN5/c1-6(7-2-4-8(11)5-3-7)13-10-14-9(12)15-16-10/h2-6H,1H3,(H4,12,13,14,15,16)