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

Systemtic Name: butyl 6-[(5E)-5-[(4-methoxyphenyl)methylidene]-2-oxidanylidene-4-sulfanylidene-1,3-thiazolidin-3-yl]hexanoate Openeye Name: butyl 6-[(5E)-5-[(4-methoxyphenyl)methylene]-2-oxo-4-thioxo-thiazolidin-3-yl]hexanoate CAS Name: 6-[(5E)-5-[(4-methoxyphenyl)methylidene]-2-oxo-4-sulfanylidene-3-thiazolidinyl]hexanoic acid butyl ester IUPAC Name: butyl 6-[(5E)-5-[(4-methoxyphenyl)methylidene]-2-oxo-4-sulfanylidene-1,3-thiazolidin-3-yl]hexanoate Traditional Name: 6-[(5E)-2-keto-5-p-anisylidene-4-thioxo-thiazolidin-3-yl]hexanoic acid butyl ester Formula: C21H27NO4S2 MolecularWeight: 421.57338

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27NO4S2/c1-3-4-14-26-19(23)8-6-5-7-13-22-20(27)18(28-21(22)24)15-16-9-11-17(25-2)12-10-16/h9-12,15H,3-8,13-14H2,1-2H3/b18-15+