propyl 4-[(5Z)-5-[(4-methoxy-3-nitro-phenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate

Systemtic Name: propyl 4-[(5Z)-5-[(4-methoxy-3-nitro-phenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate Openeye Name: propyl 4-[(5Z)-5-[(4-methoxy-3-nitro-phenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]butanoate CAS Name: 4-[(5Z)-5-[(4-methoxy-3-nitrophenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]butanoic acid propyl ester IUPAC Name: propyl 4-[(5Z)-5-[(4-methoxy-3-nitrophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate Traditional Name: 4-[(5Z)-4-keto-5-(4-methoxy-3-nitro-benzylidene)-2-thioxo-thiazolidin-3-yl]butyric acid propyl ester Formula: C18H20N2O6S2 MolecularWeight: 424.4912

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)CCCN1C(=O)C(=CC2=CC(=C(C=C2)OC)[N+](=O)[O-])SC1=S

Isomeric SMILES

CCCOC(=O)CCCN1C(=O)/C(=C/C2=CC(=C(C=C2)OC)[N+](=O)[O-])/SC1=S

InChI

InChI=1S/C18H20N2O6S2/c1-3-9-26-16(21)5-4-8-19-17(22)15(28-18(19)27)11-12-6-7-14(25-2)13(10-12)20(23)24/h6-7,10-11H,3-5,8-9H2,1-2H3/b15-11-