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

Systemtic Name: 4-(5-chloranyl-2-methoxy-phenyl)-5-pyrazin-2-yl-1,2,4-triazole-3-thiolate Openeye Name: 4-(5-chloro-2-methoxy-phenyl)-5-pyrazin-2-yl-1,2,4-triazole-3-thiolate CAS Name: 4-(5-chloro-2-methoxyphenyl)-5-(2-pyrazinyl)-1,2,4-triazole-3-thiolate IUPAC Name: 4-(5-chloro-2-methoxyphenyl)-5-pyrazin-2-yl-1,2,4-triazole-3-thiolate Traditional Name: 4-(5-chloro-2-methoxy-phenyl)-5-pyrazin-2-yl-1,2,4-triazole-3-thiolate Formula: C13H9ClN5OS- MolecularWeight: 318.76146

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)N2C(=NN=C2[S-])C3=NC=CN=C3

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)N2C(=NN=C2[S-])C3=NC=CN=C3

InChI

InChI=1S/C13H10ClN5OS/c1-20-11-3-2-8(14)6-10(11)19-12(17-18-13(19)21)9-7-15-4-5-16-9/h2-7H,1H3,(H,18,21)/p-1