propyl 2-[(5E)-5-[(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]-2-phenyl-ethanoate

Systemtic Name: propyl 2-[(5E)-5-[(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]-2-phenyl-ethanoate Openeye Name: propyl 2-[(5E)-5-[(3-bromo-4-hydroxy-5-methoxy-phenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]-2-phenyl-acetate CAS Name: 2-[(5E)-5-[(3-bromo-4-hydroxy-5-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]-2-phenylacetic acid propyl ester IUPAC Name: propyl 2-[(5E)-5-[(3-bromo-4-hydroxy-5-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-2-phenylacetate Traditional Name: 2-[(5E)-5-(3-bromo-4-hydroxy-5-methoxy-benzylidene)-4-keto-2-thioxo-thiazolidin-3-yl]-2-phenyl-acetic acid propyl ester Formula: C22H20BrNO5S2 MolecularWeight: 522.4319

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C(C1=CC=CC=C1)N2C(=O)C(=CC3=CC(=C(C(=C3)Br)O)OC)SC2=S

Isomeric SMILES

CCCOC(=O)C(C1=CC=CC=C1)N2C(=O)/C(=C\C3=CC(=C(C(=C3)Br)O)OC)/SC2=S

InChI

InChI=1S/C22H20BrNO5S2/c1-3-9-29-21(27)18(14-7-5-4-6-8-14)24-20(26)17(31-22(24)30)12-13-10-15(23)19(25)16(11-13)28-2/h4-8,10-12,18,25H,3,9H2,1-2H3/b17-12+