4-azanyl-2-[2,5-bis(chloranyl)phenyl]-5-methyl-1,2,4-triazol-3-one

Systemtic Name: 4-azanyl-2-[2,5-bis(chloranyl)phenyl]-5-methyl-1,2,4-triazol-3-one Openeye Name: 4-amino-2-(2,5-dichlorophenyl)-5-methyl-1,2,4-triazol-3-one CAS Name: 4-amino-2-(2,5-dichlorophenyl)-5-methyl-1,2,4-triazol-3-one IUPAC Name: 4-amino-2-(2,5-dichlorophenyl)-5-methyl-1,2,4-triazol-3-one Traditional Name: 4-amino-2-(2,5-dichlorophenyl)-5-methyl-1,2,4-triazol-3-one Formula: C9H8Cl2N4O MolecularWeight: 259.09202

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)N1N)C2=C(C=CC(=C2)Cl)Cl

Isomeric SMILES

CC1=NN(C(=O)N1N)C2=C(C=CC(=C2)Cl)Cl

InChI

InChI=1S/C9H8Cl2N4O/c1-5-13-15(9(16)14(5)12)8-4-6(10)2-3-7(8)11/h2-4H,12H2,1H3