butyl 6-[(5Z)-5-[(3,4-dimethoxyphenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoate

Systemtic Name: butyl 6-[(5Z)-5-[(3,4-dimethoxyphenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoate Openeye Name: butyl 6-[(5Z)-5-[(3,4-dimethoxyphenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]hexanoate CAS Name: 6-[(5Z)-5-[(3,4-dimethoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]hexanoic acid butyl ester IUPAC Name: butyl 6-[(5Z)-5-[(3,4-dimethoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoate Traditional Name: 6-[(5Z)-4-keto-2-thioxo-5-veratrylidene-thiazolidin-3-yl]hexanoic acid butyl ester Formula: C22H29NO5S2 MolecularWeight: 451.59936

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)CCCCCN1C(=O)C(=CC2=CC(=C(C=C2)OC)OC)SC1=S

Isomeric SMILES

CCCCOC(=O)CCCCCN1C(=O)/C(=C/C2=CC(=C(C=C2)OC)OC)/SC1=S

InChI

InChI=1S/C22H29NO5S2/c1-4-5-13-28-20(24)9-7-6-8-12-23-21(25)19(30-22(23)29)15-16-10-11-17(26-2)18(14-16)27-3/h10-11,14-15H,4-9,12-13H2,1-3H3/b19-15-