N-(2-fluoranyl-5-nitro-phenyl)-2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-(2-fluoranyl-5-nitro-phenyl)-2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-(2-fluoro-5-nitro-phenyl)-2-[[5-(4-pyridyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(2-fluoro-5-nitrophenyl)-2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(2-fluoro-5-nitrophenyl)-2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(2-fluoro-5-nitro-phenyl)-2-[[5-(4-pyridyl)-1H-1,2,4-triazol-3-yl]thio]acetamide Formula: C15H11FN6O3S MolecularWeight: 374.349643

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])NC(=O)CSC2=NNC(=N2)C3=CC=NC=C3)F

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])NC(=O)CSC2=NNC(=N2)C3=CC=NC=C3)F

InChI

InChI=1S/C15H11FN6O3S/c16-11-2-1-10(22(24)25)7-12(11)18-13(23)8-26-15-19-14(20-21-15)9-3-5-17-6-4-9/h1-7H,8H2,(H,18,23)(H,19,20,21)