2-[5-[(2-azanyl-2-sulfanylidene-ethanethioyl)iminomethyl]furan-2-yl]-4-nitro-phenolate

Systemtic Name: 2-[5-[(2-azanyl-2-sulfanylidene-ethanethioyl)iminomethyl]furan-2-yl]-4-nitro-phenolate Openeye Name: 2-[5-[(2-amino-2-thioxo-ethanethioyl)iminomethyl]-2-furyl]-4-nitro-phenolate CAS Name: 2-[5-[[2-amino-1,2-bis(sulfanylidene)ethyl]iminomethyl]-2-furanyl]-4-nitrophenolate IUPAC Name: 2-[5-[(2-amino-2-sulfanylideneethanethioyl)iminomethyl]furan-2-yl]-4-nitrophenolate Traditional Name: 2-[5-[(2-amino-2-thioxo-thioacetyl)iminomethyl]-2-furyl]-4-nitro-phenolate Formula: C13H8N3O4S2- MolecularWeight: 334.35032

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])C2=CC=C(O2)C=NC(=S)C(=S)N)[O-]

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])C2=CC=C(O2)C=NC(=S)C(=S)N)[O-]

InChI

InChI=1S/C13H9N3O4S2/c14-12(21)13(22)15-6-8-2-4-11(20-8)9-5-7(16(18)19)1-3-10(9)17/h1-6,17H,(H2,14,21)/p-1