2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]-N-(4-fluoranyl-2-nitro-phenyl)ethanamide

Systemtic Name: 2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]-N-(4-fluoranyl-2-nitro-phenyl)ethanamide Openeye Name: 2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]-N-(4-fluoro-2-nitro-phenyl)acetamide CAS Name: 2-[(5,6-diphenyl-1,2,4-triazin-3-yl)thio]-N-(4-fluoro-2-nitrophenyl)acetamide IUPAC Name: 2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]-N-(4-fluoro-2-nitrophenyl)acetamide Traditional Name: 2-[(5,6-diphenyl-1,2,4-triazin-3-yl)thio]-N-(4-fluoro-2-nitro-phenyl)acetamide Formula: C23H16FN5O3S MolecularWeight: 461.468243

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(N=NC(=N2)SCC(=O)NC3=C(C=C(C=C3)F)[N+](=O)[O-])C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=C(N=NC(=N2)SCC(=O)NC3=C(C=C(C=C3)F)[N+](=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C23H16FN5O3S/c24-17-11-12-18(19(13-17)29(31)32)25-20(30)14-33-23-26-21(15-7-3-1-4-8-15)22(27-28-23)16-9-5-2-6-10-16/h1-13H,14H2,(H,25,30)