methyl 2-[[(5E)-5-[(4-nitrophenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]methylamino]benzoate

Systemtic Name: methyl 2-[[(5E)-5-[(4-nitrophenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]methylamino]benzoate Openeye Name: methyl 2-[[(5E)-5-[(4-nitrophenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]methylamino]benzoate CAS Name: 2-[[(5E)-5-[(4-nitrophenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]methylamino]benzoic acid methyl ester IUPAC Name: methyl 2-[[(5E)-5-[(4-nitrophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]methylamino]benzoate Traditional Name: 2-[[(5E)-4-keto-5-(4-nitrobenzylidene)-2-thioxo-thiazolidin-3-yl]methylamino]benzoic acid methyl ester Formula: C19H15N3O5S2 MolecularWeight: 429.4695

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NCN2C(=O)C(=CC3=CC=C(C=C3)[N+](=O)[O-])SC2=S

Isomeric SMILES

COC(=O)C1=CC=CC=C1NCN2C(=O)/C(=C\C3=CC=C(C=C3)[N+](=O)[O-])/SC2=S

InChI

InChI=1S/C19H15N3O5S2/c1-27-18(24)14-4-2-3-5-15(14)20-11-21-17(23)16(29-19(21)28)10-12-6-8-13(9-7-12)22(25)26/h2-10,20H,11H2,1H3/b16-10+