3-nitro-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]pyridine

Systemtic Name: 3-nitro-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]pyridine Openeye Name: 3-nitro-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]pyridine CAS Name: 3-nitro-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)thio]pyridine IUPAC Name: 3-nitro-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]pyridine Traditional Name: 3-nitro-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)thio]pyridine Formula: C13H9N5O2S MolecularWeight: 299.30786

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=NN2)SC3=C(C=CC=N3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=NN2)SC3=C(C=CC=N3)[N+](=O)[O-]

InChI

InChI=1S/C13H9N5O2S/c19-18(20)10-7-4-8-14-12(10)21-13-15-11(16-17-13)9-5-2-1-3-6-9/h1-8H,(H,15,16,17)