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

Systemtic Name: ethyl 2-[[(5E)-5-[(4-nitrophenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]methylamino]benzoate Openeye Name: ethyl 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 ethyl ester IUPAC Name: ethyl 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 ethyl ester Formula: C20H17N3O5S2 MolecularWeight: 443.49608

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H17N3O5S2/c1-2-28-19(25)15-5-3-4-6-16(15)21-12-22-18(24)17(30-20(22)29)11-13-7-9-14(10-8-13)23(26)27/h3-11,21H,2,12H2,1H3/b17-11+