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

Systemtic Name: 3-(4-tert-butylphenyl)-5-[(3-fluoranyl-4-methoxy-phenyl)methylsulfanyl]-4-methyl-1,2,4-triazole Openeye Name: 3-(4-tert-butylphenyl)-5-[(3-fluoro-4-methoxy-phenyl)methylsulfanyl]-4-methyl-1,2,4-triazole CAS Name: 3-(4-tert-butylphenyl)-5-[(3-fluoro-4-methoxyphenyl)methylthio]-4-methyl-1,2,4-triazole IUPAC Name: 3-(4-tert-butylphenyl)-5-[(3-fluoro-4-methoxyphenyl)methylsulfanyl]-4-methyl-1,2,4-triazole Traditional Name: 3-(4-tert-butylphenyl)-5-[(3-fluoro-4-methoxy-benzyl)thio]-4-methyl-1,2,4-triazole Formula: C21H24FN3OS MolecularWeight: 385.498163

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NN=C(N2C)SCC3=CC(=C(C=C3)OC)F

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NN=C(N2C)SCC3=CC(=C(C=C3)OC)F

InChI

InChI=1S/C21H24FN3OS/c1-21(2,3)16-9-7-15(8-10-16)19-23-24-20(25(19)4)27-13-14-6-11-18(26-5)17(22)12-14/h6-12H,13H2,1-5H3