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

Systemtic Name: ethyl 4-[(5Z)-5-[(5-bromanyl-2-phenylmethoxy-phenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate Openeye Name: ethyl 4-[(5Z)-5-[(2-benzyloxy-5-bromo-phenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]butanoate CAS Name: 4-[(5Z)-5-[(5-bromo-2-phenylmethoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]butanoic acid ethyl ester IUPAC Name: ethyl 4-[(5Z)-5-[(5-bromo-2-phenylmethoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate Traditional Name: 4-[(5Z)-5-(2-benzoxy-5-bromo-benzylidene)-4-keto-2-thioxo-thiazolidin-3-yl]butyric acid ethyl ester Formula: C23H22BrNO4S2 MolecularWeight: 520.45908

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCN1C(=O)C(=CC2=C(C=CC(=C2)Br)OCC3=CC=CC=C3)SC1=S

Isomeric SMILES

CCOC(=O)CCCN1C(=O)/C(=C/C2=C(C=CC(=C2)Br)OCC3=CC=CC=C3)/SC1=S

InChI

InChI=1S/C23H22BrNO4S2/c1-2-28-21(26)9-6-12-25-22(27)20(31-23(25)30)14-17-13-18(24)10-11-19(17)29-15-16-7-4-3-5-8-16/h3-5,7-8,10-11,13-14H,2,6,9,12,15H2,1H3/b20-14-