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

Systemtic Name: methyl 4-[(5Z)-5-[(3-bromanyl-5-methoxy-4-phenylmethoxy-phenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate Openeye Name: methyl 4-[(5Z)-5-[(4-benzyloxy-3-bromo-5-methoxy-phenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]butanoate CAS Name: 4-[(5Z)-5-[(3-bromo-5-methoxy-4-phenylmethoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]butanoic acid methyl ester IUPAC Name: methyl 4-[(5Z)-5-[(3-bromo-5-methoxy-4-phenylmethoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate Traditional Name: 4-[(5Z)-5-(4-benzoxy-3-bromo-5-methoxy-benzylidene)-4-keto-2-thioxo-thiazolidin-3-yl]butyric acid methyl ester Formula: C23H22BrNO5S2 MolecularWeight: 536.45848

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H22BrNO5S2/c1-28-18-12-16(11-17(24)21(18)30-14-15-7-4-3-5-8-15)13-19-22(27)25(23(31)32-19)10-6-9-20(26)29-2/h3-5,7-8,11-13H,6,9-10,14H2,1-2H3/b19-13-