5-(4-chlorophenyl)-2-methylsulfonyl-1,2,4-triazol-3-amine

Systemtic Name: 5-(4-chlorophenyl)-2-methylsulfonyl-1,2,4-triazol-3-amine Openeye Name: 5-(4-chlorophenyl)-2-methylsulfonyl-1,2,4-triazol-3-amine CAS Name: 5-(4-chlorophenyl)-2-methylsulfonyl-1,2,4-triazol-3-amine IUPAC Name: 5-(4-chlorophenyl)-2-methylsulfonyl-1,2,4-triazol-3-amine Traditional Name: [5-(4-chlorophenyl)-2-mesyl-1,2,4-triazol-3-yl]amine Formula: C9H9ClN4O2S MolecularWeight: 272.71136

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1C(=NC(=N1)C2=CC=C(C=C2)Cl)N

Isomeric SMILES

CS(=O)(=O)N1C(=NC(=N1)C2=CC=C(C=C2)Cl)N

InChI

InChI=1S/C9H9ClN4O2S/c1-17(15,16)14-9(11)12-8(13-14)6-2-4-7(10)5-3-6/h2-5H,1H3,(H2,11,12,13)