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

Systemtic Name: 3-[(3-fluoranyl-4-methoxy-phenyl)methylsulfanyl]-4-phenyl-1,2,4-triazole Openeye Name: 3-[(3-fluoro-4-methoxy-phenyl)methylsulfanyl]-4-phenyl-1,2,4-triazole CAS Name: 3-[(3-fluoro-4-methoxyphenyl)methylthio]-4-phenyl-1,2,4-triazole IUPAC Name: 3-[(3-fluoro-4-methoxyphenyl)methylsulfanyl]-4-phenyl-1,2,4-triazole Traditional Name: 3-[(3-fluoro-4-methoxy-benzyl)thio]-4-phenyl-1,2,4-triazole Formula: C16H14FN3OS MolecularWeight: 315.365263

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CSC2=NN=CN2C3=CC=CC=C3)F

Isomeric SMILES

COC1=C(C=C(C=C1)CSC2=NN=CN2C3=CC=CC=C3)F

InChI

InChI=1S/C16H14FN3OS/c1-21-15-8-7-12(9-14(15)17)10-22-16-19-18-11-20(16)13-5-3-2-4-6-13/h2-9,11H,10H2,1H3