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

Systemtic Name: 2-methylpropyl 2-[(5Z)-5-[(3-bromanyl-5-ethoxy-4-oxidanyl-phenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanoate Openeye Name: isobutyl 2-[(5Z)-5-[(3-bromo-5-ethoxy-4-hydroxy-phenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]acetate CAS Name: 2-[(5Z)-5-[(3-bromo-5-ethoxy-4-hydroxyphenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]acetic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 2-[(5Z)-5-[(3-bromo-5-ethoxy-4-hydroxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetate Traditional Name: 2-[(5Z)-5-(3-bromo-5-ethoxy-4-hydroxy-benzylidene)-4-keto-2-thioxo-thiazolidin-3-yl]acetic acid isobutyl ester Formula: C18H20BrNO5S2 MolecularWeight: 474.3891

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=C2C(=O)N(C(=S)S2)CC(=O)OCC(C)C)Br)O

Isomeric SMILES

CCOC1=C(C(=CC(=C1)/C=C\2/C(=O)N(C(=S)S2)CC(=O)OCC(C)C)Br)O

InChI

InChI=1S/C18H20BrNO5S2/c1-4-24-13-6-11(5-12(19)16(13)22)7-14-17(23)20(18(26)27-14)8-15(21)25-9-10(2)3/h5-7,10,22H,4,8-9H2,1-3H3/b14-7-