4-bromanyl-2-[(3-ethyl-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-6-nitro-phenolate

Systemtic Name: 4-bromanyl-2-[(3-ethyl-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-6-nitro-phenolate Openeye Name: 4-bromo-2-[(3-ethyl-4-oxo-2-thioxo-thiazolidin-5-ylidene)methyl]-6-nitro-phenolate CAS Name: 4-bromo-2-[(3-ethyl-4-oxo-2-sulfanylidene-5-thiazolidinylidene)methyl]-6-nitrophenolate IUPAC Name: 4-bromo-2-[(3-ethyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-6-nitrophenolate Traditional Name: 4-bromo-2-[(3-ethyl-4-keto-2-thioxo-thiazolidin-5-ylidene)methyl]-6-nitro-phenolate Formula: C12H8BrN2O4S2- MolecularWeight: 388.23692

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C(=CC2=CC(=CC(=C2[O-])[N+](=O)[O-])Br)SC1=S

Isomeric SMILES

CCN1C(=O)C(=CC2=CC(=CC(=C2[O-])[N+](=O)[O-])Br)SC1=S

InChI

InChI=1S/C12H9BrN2O4S2/c1-2-14-11(17)9(21-12(14)20)4-6-3-7(13)5-8(10(6)16)15(18)19/h3-5,16H,2H2,1H3/p-1