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

Systemtic Name: 5-[(3-fluoranyl-4-methoxy-phenyl)methylsulfanyl]-1H-1,2,4-triazole Openeye Name: 5-[(3-fluoro-4-methoxy-phenyl)methylsulfanyl]-1H-1,2,4-triazole CAS Name: 5-[(3-fluoro-4-methoxyphenyl)methylthio]-1H-1,2,4-triazole IUPAC Name: 5-[(3-fluoro-4-methoxyphenyl)methylsulfanyl]-1H-1,2,4-triazole Traditional Name: 5-[(3-fluoro-4-methoxy-benzyl)thio]-1H-1,2,4-triazole Formula: C10H10FN3OS MolecularWeight: 239.269303

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CSC2=NC=NN2)F

Isomeric SMILES

COC1=C(C=C(C=C1)CSC2=NC=NN2)F

InChI

InChI=1S/C10H10FN3OS/c1-15-9-3-2-7(4-8(9)11)5-16-10-12-6-13-14-10/h2-4,6H,5H2,1H3,(H,12,13,14)