methyl 3-[(5Z)-5-[(3-bromanyl-5-methoxy-4-phenylmethoxy-phenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoate

Systemtic Name: methyl 3-[(5Z)-5-[(3-bromanyl-5-methoxy-4-phenylmethoxy-phenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoate Openeye Name: methyl 3-[(5Z)-5-[(4-benzyloxy-3-bromo-5-methoxy-phenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]propanoate CAS Name: 3-[(5Z)-5-[(3-bromo-5-methoxy-4-phenylmethoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]propanoic acid methyl ester IUPAC Name: methyl 3-[(5Z)-5-[(3-bromo-5-methoxy-4-phenylmethoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoate Traditional Name: 3-[(5Z)-5-(4-benzoxy-3-bromo-5-methoxy-benzylidene)-4-keto-2-thioxo-thiazolidin-3-yl]propionic acid methyl ester Formula: C22H20BrNO5S2 MolecularWeight: 522.4319

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=C2C(=O)N(C(=S)S2)CCC(=O)OC)Br)OCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C(=CC(=C1)/C=C\2/C(=O)N(C(=S)S2)CCC(=O)OC)Br)OCC3=CC=CC=C3

InChI

InChI=1S/C22H20BrNO5S2/c1-27-17-11-15(10-16(23)20(17)29-13-14-6-4-3-5-7-14)12-18-21(26)24(22(30)31-18)9-8-19(25)28-2/h3-7,10-12H,8-9,13H2,1-2H3/b18-12-