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

Systemtic Name: 4-[(E)-(3-benzamido-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-2-nitro-phenolate Openeye Name: 4-[(E)-(3-benzamido-4-oxo-2-thioxo-thiazolidin-5-ylidene)methyl]-2-nitro-phenolate CAS Name: 4-[(E)-(3-benzamido-4-oxo-2-sulfanylidene-5-thiazolidinylidene)methyl]-2-nitrophenolate IUPAC Name: 4-[(E)-(3-benzamido-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-2-nitrophenolate Traditional Name: 4-[(E)-(3-benzamido-4-keto-2-thioxo-thiazolidin-5-ylidene)methyl]-2-nitro-phenolate Formula: C17H10N3O5S2- MolecularWeight: 400.4084

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NN2C(=O)C(=CC3=CC(=C(C=C3)[O-])[N+](=O)[O-])SC2=S

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NN2C(=O)/C(=C\C3=CC(=C(C=C3)[O-])[N+](=O)[O-])/SC2=S

InChI

InChI=1S/C17H11N3O5S2/c21-13-7-6-10(8-12(13)20(24)25)9-14-16(23)19(17(26)27-14)18-15(22)11-4-2-1-3-5-11/h1-9,21H,(H,18,22)/p-1/b14-9+