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

Systemtic Name: 2-bromanyl-6-[(E)-[3-(2,4-dimethylphenyl)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-4-nitro-phenolate Openeye Name: 2-bromo-6-[(E)-[3-(2,4-dimethylphenyl)-4-oxo-2-thioxo-thiazolidin-5-ylidene]methyl]-4-nitro-phenolate CAS Name: 2-bromo-6-[(E)-[3-(2,4-dimethylphenyl)-4-oxo-2-sulfanylidene-5-thiazolidinylidene]methyl]-4-nitrophenolate IUPAC Name: 2-bromo-6-[(E)-[3-(2,4-dimethylphenyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-4-nitrophenolate Traditional Name: 2-bromo-6-[(E)-[3-(2,4-dimethylphenyl)-4-keto-2-thioxo-thiazolidin-5-ylidene]methyl]-4-nitro-phenolate Formula: C18H12BrN2O4S2- MolecularWeight: 464.33288

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C(=O)C(=CC3=CC(=CC(=C3[O-])Br)[N+](=O)[O-])SC2=S)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C(=O)/C(=C\C3=CC(=CC(=C3[O-])Br)[N+](=O)[O-])/SC2=S)C

InChI

InChI=1S/C18H13BrN2O4S2/c1-9-3-4-14(10(2)5-9)20-17(23)15(27-18(20)26)7-11-6-12(21(24)25)8-13(19)16(11)22/h3-8,22H,1-2H3/p-1/b15-7+