4-(4-ethoxy-2-nitro-phenyl)-5-pyridin-4-yl-1,2,4-triazole-3-thiolate

Systemtic Name: 4-(4-ethoxy-2-nitro-phenyl)-5-pyridin-4-yl-1,2,4-triazole-3-thiolate Openeye Name: 4-(4-ethoxy-2-nitro-phenyl)-5-(4-pyridyl)-1,2,4-triazole-3-thiolate CAS Name: 4-(4-ethoxy-2-nitrophenyl)-5-pyridin-4-yl-1,2,4-triazole-3-thiolate IUPAC Name: 4-(4-ethoxy-2-nitrophenyl)-5-pyridin-4-yl-1,2,4-triazole-3-thiolate Traditional Name: 4-(4-ethoxy-2-nitro-phenyl)-5-(4-pyridyl)-1,2,4-triazole-3-thiolate Formula: C15H12N5O3S- MolecularWeight: 342.35248

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)N2C(=NN=C2[S-])C3=CC=NC=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC(=C(C=C1)N2C(=NN=C2[S-])C3=CC=NC=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H13N5O3S/c1-2-23-11-3-4-12(13(9-11)20(21)22)19-14(17-18-15(19)24)10-5-7-16-8-6-10/h3-9H,2H2,1H3,(H,18,24)/p-1