5-[(4-nitrophenoxy)methyl]-4-phenyl-1,2,4-triazole-3-thiolate

Systemtic Name: 5-[(4-nitrophenoxy)methyl]-4-phenyl-1,2,4-triazole-3-thiolate Openeye Name: 5-[(4-nitrophenoxy)methyl]-4-phenyl-1,2,4-triazole-3-thiolate CAS Name: 5-[(4-nitrophenoxy)methyl]-4-phenyl-1,2,4-triazole-3-thiolate IUPAC Name: 5-[(4-nitrophenoxy)methyl]-4-phenyl-1,2,4-triazole-3-thiolate Traditional Name: 5-[(4-nitrophenoxy)methyl]-4-phenyl-1,2,4-triazole-3-thiolate Formula: C15H11N4O3S- MolecularWeight: 327.33784

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=C2[S-])COC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=C2[S-])COC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H12N4O3S/c20-19(21)12-6-8-13(9-7-12)22-10-14-16-17-15(23)18(14)11-4-2-1-3-5-11/h1-9H,10H2,(H,17,23)/p-1