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

Systemtic Name: 5-(5-chloranyl-2-methoxy-phenyl)-3-[(3-fluoranyl-4-methoxy-phenyl)methylsulfanyl]-1H-1,2,4-triazole Openeye Name: 5-(5-chloro-2-methoxy-phenyl)-3-[(3-fluoro-4-methoxy-phenyl)methylsulfanyl]-1H-1,2,4-triazole CAS Name: 5-(5-chloro-2-methoxyphenyl)-3-[(3-fluoro-4-methoxyphenyl)methylthio]-1H-1,2,4-triazole IUPAC Name: 5-(5-chloro-2-methoxyphenyl)-3-[(3-fluoro-4-methoxyphenyl)methylsulfanyl]-1H-1,2,4-triazole Traditional Name: 5-(5-chloro-2-methoxy-phenyl)-3-[(3-fluoro-4-methoxy-benzyl)thio]-1H-1,2,4-triazole Formula: C17H15ClFN3O2S MolecularWeight: 379.836303

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15ClFN3O2S/c1-23-14-6-4-11(18)8-12(14)16-20-17(22-21-16)25-9-10-3-5-15(24-2)13(19)7-10/h3-8H,9H2,1-2H3,(H,20,21,22)