5-phenyl-3-[(4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,2-oxazole

Systemtic Name: 5-phenyl-3-[(4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,2-oxazole Openeye Name: 5-phenyl-3-[(4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]isoxazole CAS Name: 5-phenyl-3-[[(4-phenyl-1,2,4-triazol-3-yl)thio]methyl]isoxazole IUPAC Name: 5-phenyl-3-[(4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,2-oxazole Traditional Name: 5-phenyl-3-[[(4-phenyl-1,2,4-triazol-3-yl)thio]methyl]isoxazole Formula: C18H14N4OS MolecularWeight: 334.39496

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=NO2)CSC3=NN=CN3C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=NO2)CSC3=NN=CN3C4=CC=CC=C4

InChI

InChI=1S/C18H14N4OS/c1-3-7-14(8-4-1)17-11-15(21-23-17)12-24-18-20-19-13-22(18)16-9-5-2-6-10-16/h1-11,13H,12H2