3-[(5-fluoranyl-2-methoxy-phenyl)methylsulfanyl]-5-(4-methoxyphenyl)-1H-1,2,4-triazole

Systemtic Name: 3-[(5-fluoranyl-2-methoxy-phenyl)methylsulfanyl]-5-(4-methoxyphenyl)-1H-1,2,4-triazole Openeye Name: 3-[(5-fluoro-2-methoxy-phenyl)methylsulfanyl]-5-(4-methoxyphenyl)-1H-1,2,4-triazole CAS Name: 3-[(5-fluoro-2-methoxyphenyl)methylthio]-5-(4-methoxyphenyl)-1H-1,2,4-triazole IUPAC Name: 3-[(5-fluoro-2-methoxyphenyl)methylsulfanyl]-5-(4-methoxyphenyl)-1H-1,2,4-triazole Traditional Name: 3-[(5-fluoro-2-methoxy-benzyl)thio]-5-(4-methoxyphenyl)-1H-1,2,4-triazole Formula: C17H16FN3O2S MolecularWeight: 345.391243

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC(=NN2)SCC3=C(C=CC(=C3)F)OC

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC(=NN2)SCC3=C(C=CC(=C3)F)OC

InChI

InChI=1S/C17H16FN3O2S/c1-22-14-6-3-11(4-7-14)16-19-17(21-20-16)24-10-12-9-13(18)5-8-15(12)23-2/h3-9H,10H2,1-2H3,(H,19,20,21)