2-[(5Z)-5-[(2-bromanyl-5-ethoxy-4-propan-2-yloxy-phenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]-4-methylsulfanyl-butanoic acid

Systemtic Name: 2-[(5Z)-5-[(2-bromanyl-5-ethoxy-4-propan-2-yloxy-phenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]-4-methylsulfanyl-butanoic acid Openeye Name: 2-[(5Z)-5-[(2-bromo-5-ethoxy-4-isopropoxy-phenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]-4-methylsulfanyl-butanoic acid CAS Name: 2-[(5Z)-5-[(2-bromo-5-ethoxy-4-propan-2-yloxyphenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]-4-(methylthio)butanoic acid IUPAC Name: 2-[(5Z)-5-[(2-bromo-5-ethoxy-4-propan-2-yloxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-4-methylsulfanylbutanoic acid Traditional Name: 2-[(5Z)-5-(2-bromo-5-ethoxy-4-isopropoxy-benzylidene)-4-keto-2-thioxo-thiazolidin-3-yl]-4-(methylthio)butyric acid Formula: C20H24BrNO5S3 MolecularWeight: 534.50726

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)C=C2C(=O)N(C(=S)S2)C(CCSC)C(=O)O)Br)OC(C)C

Isomeric SMILES

CCOC1=C(C=C(C(=C1)/C=C\2/C(=O)N(C(=S)S2)C(CCSC)C(=O)O)Br)OC(C)C

InChI

InChI=1S/C20H24BrNO5S3/c1-5-26-15-8-12(13(21)10-16(15)27-11(2)3)9-17-18(23)22(20(28)30-17)14(19(24)25)6-7-29-4/h8-11,14H,5-7H2,1-4H3,(H,24,25)/b17-9-