3-[(2-bromanyl-4-fluoranyl-phenyl)methylsulfanyl]-4-ethyl-5-(2-methylfuran-3-yl)-1,2,4-triazole

Systemtic Name: 3-[(2-bromanyl-4-fluoranyl-phenyl)methylsulfanyl]-4-ethyl-5-(2-methylfuran-3-yl)-1,2,4-triazole Openeye Name: 3-[(2-bromo-4-fluoro-phenyl)methylsulfanyl]-4-ethyl-5-(2-methyl-3-furyl)-1,2,4-triazole CAS Name: 3-[(2-bromo-4-fluorophenyl)methylthio]-4-ethyl-5-(2-methyl-3-furanyl)-1,2,4-triazole IUPAC Name: 3-[(2-bromo-4-fluorophenyl)methylsulfanyl]-4-ethyl-5-(2-methylfuran-3-yl)-1,2,4-triazole Traditional Name: 3-[(2-bromo-4-fluoro-benzyl)thio]-4-ethyl-5-(2-methyl-3-furyl)-1,2,4-triazole Formula: C16H15BrFN3OS MolecularWeight: 396.277203

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC2=C(C=C(C=C2)F)Br)C3=C(OC=C3)C

Isomeric SMILES

CCN1C(=NN=C1SCC2=C(C=C(C=C2)F)Br)C3=C(OC=C3)C

InChI

InChI=1S/C16H15BrFN3OS/c1-3-21-15(13-6-7-22-10(13)2)19-20-16(21)23-9-11-4-5-12(18)8-14(11)17/h4-8H,3,9H2,1-2H3