2-[5-(2,4-dinitrophenyl)sulfanyl-1,2,3,4-tetrazol-1-yl]ethanamine

Systemtic Name: 2-[5-(2,4-dinitrophenyl)sulfanyl-1,2,3,4-tetrazol-1-yl]ethanamine Openeye Name: 2-[5-(2,4-dinitrophenyl)sulfanyltetrazol-1-yl]ethanamine CAS Name: 2-[5-[(2,4-dinitrophenyl)thio]-1-tetrazolyl]ethanamine IUPAC Name: 2-[5-(2,4-dinitrophenyl)sulfanyltetrazol-1-yl]ethanamine Traditional Name: 2-[5-[(2,4-dinitrophenyl)thio]tetrazol-1-yl]ethylamine Formula: C9H9N7O4S MolecularWeight: 311.27726

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])SC2=NN=NN2CCN

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])SC2=NN=NN2CCN

InChI

InChI=1S/C9H9N7O4S/c10-3-4-14-9(11-12-13-14)21-8-2-1-6(15(17)18)5-7(8)16(19)20/h1-2,5H,3-4,10H2