4-(3-chloranyl-4-fluoranyl-phenyl)-5-pyrazin-2-yl-1,2,4-triazole-3-thiolate

Systemtic Name: 4-(3-chloranyl-4-fluoranyl-phenyl)-5-pyrazin-2-yl-1,2,4-triazole-3-thiolate Openeye Name: 4-(3-chloro-4-fluoro-phenyl)-5-pyrazin-2-yl-1,2,4-triazole-3-thiolate CAS Name: 4-(3-chloro-4-fluorophenyl)-5-(2-pyrazinyl)-1,2,4-triazole-3-thiolate IUPAC Name: 4-(3-chloro-4-fluorophenyl)-5-pyrazin-2-yl-1,2,4-triazole-3-thiolate Traditional Name: 4-(3-chloro-4-fluoro-phenyl)-5-pyrazin-2-yl-1,2,4-triazole-3-thiolate Formula: C12H6ClFN5S- MolecularWeight: 306.725943

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1N2C(=NN=C2[S-])C3=NC=CN=C3)Cl)F

Isomeric SMILES

C1=CC(=C(C=C1N2C(=NN=C2[S-])C3=NC=CN=C3)Cl)F

InChI

InChI=1S/C12H7ClFN5S/c13-8-5-7(1-2-9(8)14)19-11(17-18-12(19)20)10-6-15-3-4-16-10/h1-6H,(H,18,20)/p-1