1-(6-nitrobenzotriazol-1-yl)ethanethione

Systemtic Name: 1-(6-nitrobenzotriazol-1-yl)ethanethione Openeye Name: 1-(6-nitrobenzotriazol-1-yl)ethanethione CAS Name: 1-(6-nitro-1-benzotriazolyl)ethanethione IUPAC Name: 1-(6-nitrobenzotriazol-1-yl)ethanethione Traditional Name: 1-(6-nitrobenzotriazol-1-yl)ethanethione Formula: C8H6N4O2S MolecularWeight: 222.22384

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Descriptors Computed from Structure

Canonical SMILES:

CC(=S)N1C2=C(C=CC(=C2)[N+](=O)[O-])N=N1

Isomeric SMILES

CC(=S)N1C2=C(C=CC(=C2)[N+](=O)[O-])N=N1

InChI

InChI=1S/C8H6N4O2S/c1-5(15)11-8-4-6(12(13)14)2-3-7(8)9-10-11/h2-4H,1H3