5-[(4-nitrophenyl)sulfanylmethyl]-2H-1,2,3,4-tetrazole

Systemtic Name: 5-[(4-nitrophenyl)sulfanylmethyl]-2H-1,2,3,4-tetrazole Openeye Name: 5-[(4-nitrophenyl)sulfanylmethyl]-2H-tetrazole CAS Name: 5-[[(4-nitrophenyl)thio]methyl]-2H-tetrazole IUPAC Name: 5-[(4-nitrophenyl)sulfanylmethyl]-2H-tetrazole Traditional Name: 5-[[(4-nitrophenyl)thio]methyl]-2H-tetrazole Formula: C8H7N5O2S MolecularWeight: 237.23848

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1[N+](=O)[O-])SCC2=NNN=N2

Isomeric SMILES

C1=CC(=CC=C1[N+](=O)[O-])SCC2=NNN=N2

InChI

InChI=1S/C8H7N5O2S/c14-13(15)6-1-3-7(4-2-6)16-5-8-9-11-12-10-8/h1-4H,5H2,(H,9,10,11,12)