4-[(5-tert-butyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-2-(4-fluorophenyl)-1,3-oxazole

Systemtic Name: 4-[(5-tert-butyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-2-(4-fluorophenyl)-1,3-oxazole Openeye Name: 4-[(5-tert-butyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-2-(4-fluorophenyl)oxazole CAS Name: 4-[[(5-tert-butyl-1H-1,2,4-triazol-3-yl)thio]methyl]-2-(4-fluorophenyl)oxazole IUPAC Name: 4-[(5-tert-butyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-2-(4-fluorophenyl)-1,3-oxazole Traditional Name: 4-[[(5-tert-butyl-1H-1,2,4-triazol-3-yl)thio]methyl]-2-(4-fluorophenyl)oxazole Formula: C16H17FN4OS MolecularWeight: 332.395783

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC(=NN1)SCC2=COC(=N2)C3=CC=C(C=C3)F

Isomeric SMILES

CC(C)(C)C1=NC(=NN1)SCC2=COC(=N2)C3=CC=C(C=C3)F

InChI

InChI=1S/C16H17FN4OS/c1-16(2,3)14-19-15(21-20-14)23-9-12-8-22-13(18-12)10-4-6-11(17)7-5-10/h4-8H,9H2,1-3H3,(H,19,20,21)