5-[(5Z)-5-[(3-bromanyl-5-methoxy-4-prop-2-enoxy-phenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]pentanoic acid

Systemtic Name: 5-[(5Z)-5-[(3-bromanyl-5-methoxy-4-prop-2-enoxy-phenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]pentanoic acid Openeye Name: 5-[(5Z)-5-[(4-allyloxy-3-bromo-5-methoxy-phenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]pentanoic acid CAS Name: 5-[(5Z)-5-[(3-bromo-5-methoxy-4-prop-2-enoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]pentanoic acid IUPAC Name: 5-[(5Z)-5-[(3-bromo-5-methoxy-4-prop-2-enoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]pentanoic acid Traditional Name: 5-[(5Z)-5-(4-allyloxy-3-bromo-5-methoxy-benzylidene)-4-keto-2-thioxo-thiazolidin-3-yl]valeric acid Formula: C19H20BrNO5S2 MolecularWeight: 486.3998

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=C2C(=O)N(C(=S)S2)CCCCC(=O)O)Br)OCC=C

Isomeric SMILES

COC1=C(C(=CC(=C1)/C=C\2/C(=O)N(C(=S)S2)CCCCC(=O)O)Br)OCC=C

InChI

InChI=1S/C19H20BrNO5S2/c1-3-8-26-17-13(20)9-12(10-14(17)25-2)11-15-18(24)21(19(27)28-15)7-5-4-6-16(22)23/h3,9-11H,1,4-8H2,2H3,(H,22,23)/b15-11-