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

Systemtic Name: propyl 3-[(5E)-5-[(5-bromanyl-2-butoxy-phenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoate Openeye Name: propyl 3-[(5E)-5-[(5-bromo-2-butoxy-phenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]propanoate CAS Name: 3-[(5E)-5-[(5-bromo-2-butoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]propanoic acid propyl ester IUPAC Name: propyl 3-[(5E)-5-[(5-bromo-2-butoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoate Traditional Name: 3-[(5E)-5-(5-bromo-2-butoxy-benzylidene)-4-keto-2-thioxo-thiazolidin-3-yl]propionic acid propyl ester Formula: C20H24BrNO4S2 MolecularWeight: 486.44286

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)Br)C=C2C(=O)N(C(=S)S2)CCC(=O)OCCC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)Br)/C=C/2\C(=O)N(C(=S)S2)CCC(=O)OCCC

InChI

InChI=1S/C20H24BrNO4S2/c1-3-5-11-25-16-7-6-15(21)12-14(16)13-17-19(24)22(20(27)28-17)9-8-18(23)26-10-4-2/h6-7,12-13H,3-5,8-11H2,1-2H3/b17-13+