5-phenyl-3-[(1-phenyl-1,2,3,4-tetrazol-5-yl)methylsulfanylmethyl]-1,2-oxazole

Systemtic Name: 5-phenyl-3-[(1-phenyl-1,2,3,4-tetrazol-5-yl)methylsulfanylmethyl]-1,2-oxazole Openeye Name: 5-phenyl-3-[(1-phenyltetrazol-5-yl)methylsulfanylmethyl]isoxazole CAS Name: 5-phenyl-3-[[(1-phenyl-5-tetrazolyl)methylthio]methyl]isoxazole IUPAC Name: 5-phenyl-3-[(1-phenyltetrazol-5-yl)methylsulfanylmethyl]-1,2-oxazole Traditional Name: 5-phenyl-3-[[(1-phenyltetrazol-5-yl)methylthio]methyl]isoxazole Formula: C18H15N5OS MolecularWeight: 349.4096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=NO2)CSCC3=NN=NN3C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=NO2)CSCC3=NN=NN3C4=CC=CC=C4

InChI

InChI=1S/C18H15N5OS/c1-3-7-14(8-4-1)17-11-15(20-24-17)12-25-13-18-19-21-22-23(18)16-9-5-2-6-10-16/h1-11H,12-13H2