5-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]-2,1,3-benzoxadiazole

Systemtic Name: 5-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]-2,1,3-benzoxadiazole Openeye Name: 5-[(1-phenyltetrazol-5-yl)sulfanylmethyl]-2,1,3-benzoxadiazole CAS Name: 5-[[(1-phenyl-5-tetrazolyl)thio]methyl]-2,1,3-benzoxadiazole IUPAC Name: 5-[(1-phenyltetrazol-5-yl)sulfanylmethyl]-2,1,3-benzoxadiazole Traditional Name: 5-[[(1-phenyltetrazol-5-yl)thio]methyl]benzofurazan Formula: C14H10N6OS MolecularWeight: 310.3338

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=N2)SCC3=CC4=NON=C4C=C3

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=N2)SCC3=CC4=NON=C4C=C3

InChI

InChI=1S/C14H10N6OS/c1-2-4-11(5-3-1)20-14(15-18-19-20)22-9-10-6-7-12-13(8-10)17-21-16-12/h1-8H,9H2