5-(2-fluorophenyl)-3-[(4-nitrophenyl)methylsulfanyl]-1H-1,2,4-triazole

Systemtic Name: 5-(2-fluorophenyl)-3-[(4-nitrophenyl)methylsulfanyl]-1H-1,2,4-triazole Openeye Name: 5-(2-fluorophenyl)-3-[(4-nitrophenyl)methylsulfanyl]-1H-1,2,4-triazole CAS Name: 5-(2-fluorophenyl)-3-[(4-nitrophenyl)methylthio]-1H-1,2,4-triazole IUPAC Name: 5-(2-fluorophenyl)-3-[(4-nitrophenyl)methylsulfanyl]-1H-1,2,4-triazole Traditional Name: 5-(2-fluorophenyl)-3-[(4-nitrobenzyl)thio]-1H-1,2,4-triazole Formula: C15H11FN4O2S MolecularWeight: 330.336843

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=NC(=NN2)SCC3=CC=C(C=C3)[N+](=O)[O-])F

Isomeric SMILES

C1=CC=C(C(=C1)C2=NC(=NN2)SCC3=CC=C(C=C3)[N+](=O)[O-])F

InChI

InChI=1S/C15H11FN4O2S/c16-13-4-2-1-3-12(13)14-17-15(19-18-14)23-9-10-5-7-11(8-6-10)20(21)22/h1-8H,9H2,(H,17,18,19)