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

Systemtic Name: propyl 2-[(5E)-5-[(5-bromanyl-2-oxidanyl-phenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]-2-phenyl-ethanoate Openeye Name: propyl 2-[(5E)-5-[(5-bromo-2-hydroxy-phenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]-2-phenyl-acetate CAS Name: 2-[(5E)-5-[(5-bromo-2-hydroxyphenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]-2-phenylacetic acid propyl ester IUPAC Name: propyl 2-[(5E)-5-[(5-bromo-2-hydroxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-2-phenylacetate Traditional Name: 2-[(5E)-5-(5-bromo-2-hydroxy-benzylidene)-4-keto-2-thioxo-thiazolidin-3-yl]-2-phenyl-acetic acid propyl ester Formula: C21H18BrNO4S2 MolecularWeight: 492.40592

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H18BrNO4S2/c1-2-10-27-20(26)18(13-6-4-3-5-7-13)23-19(25)17(29-21(23)28)12-14-11-15(22)8-9-16(14)24/h3-9,11-12,18,24H,2,10H2,1H3/b17-12+