5-(6-chloranyl-4-cyano-pyridin-2-yl)sulfanyl-4-phenyl-1,2,4-triazol-3-olate

Systemtic Name: 5-(6-chloranyl-4-cyano-pyridin-2-yl)sulfanyl-4-phenyl-1,2,4-triazol-3-olate Openeye Name: 5-[(6-chloro-4-cyano-2-pyridyl)sulfanyl]-4-phenyl-1,2,4-triazol-3-olate CAS Name: 5-[(6-chloro-4-cyano-2-pyridinyl)thio]-4-phenyl-1,2,4-triazol-3-olate IUPAC Name: 5-(6-chloro-4-cyanopyridin-2-yl)sulfanyl-4-phenyl-1,2,4-triazol-3-olate Traditional Name: 5-[(6-chloro-4-cyano-2-pyridyl)thio]-4-phenyl-1,2,4-triazol-3-olate Formula: C14H7ClN5OS- MolecularWeight: 328.75628

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=C2SC3=NC(=CC(=C3)C#N)Cl)[O-]

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=C2SC3=NC(=CC(=C3)C#N)Cl)[O-]

InChI

InChI=1S/C14H8ClN5OS/c15-11-6-9(8-16)7-12(17-11)22-14-19-18-13(21)20(14)10-4-2-1-3-5-10/h1-7H,(H,18,21)/p-1