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

Systemtic Name: 3-[(5Z)-5-[(3-bromanyl-5-methoxy-4-pentoxy-phenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid Openeye Name: 3-[(5Z)-5-[(3-bromo-5-methoxy-4-pentoxy-phenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]propanoic acid CAS Name: 3-[(5Z)-5-[(3-bromo-5-methoxy-4-pentoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]propanoic acid IUPAC Name: 3-[(5Z)-5-[(3-bromo-5-methoxy-4-pentoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid Traditional Name: 3-[(5Z)-5-(4-amoxy-3-bromo-5-methoxy-benzylidene)-4-keto-2-thioxo-thiazolidin-3-yl]propionic acid Formula: C19H22BrNO5S2 MolecularWeight: 488.41568

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=C(C=C1Br)C=C2C(=O)N(C(=S)S2)CCC(=O)O)OC

Isomeric SMILES

CCCCCOC1=C(C=C(C=C1Br)/C=C\2/C(=O)N(C(=S)S2)CCC(=O)O)OC

InChI

InChI=1S/C19H22BrNO5S2/c1-3-4-5-8-26-17-13(20)9-12(10-14(17)25-2)11-15-18(24)21(19(27)28-15)7-6-16(22)23/h9-11H,3-8H2,1-2H3,(H,22,23)/b15-11-