pentyl 4-[(5E)-5-[(4-methoxyphenyl)methylidene]-2-oxidanylidene-4-sulfanylidene-1,3-thiazolidin-3-yl]butanoate

Systemtic Name: pentyl 4-[(5E)-5-[(4-methoxyphenyl)methylidene]-2-oxidanylidene-4-sulfanylidene-1,3-thiazolidin-3-yl]butanoate Openeye Name: pentyl 4-[(5E)-5-[(4-methoxyphenyl)methylene]-2-oxo-4-thioxo-thiazolidin-3-yl]butanoate CAS Name: 4-[(5E)-5-[(4-methoxyphenyl)methylidene]-2-oxo-4-sulfanylidene-3-thiazolidinyl]butanoic acid pentyl ester IUPAC Name: pentyl 4-[(5E)-5-[(4-methoxyphenyl)methylidene]-2-oxo-4-sulfanylidene-1,3-thiazolidin-3-yl]butanoate Traditional Name: 4-[(5E)-2-keto-5-p-anisylidene-4-thioxo-thiazolidin-3-yl]butyric acid amyl ester Formula: C20H25NO4S2 MolecularWeight: 407.5468

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)CCCN1C(=S)C(=CC2=CC=C(C=C2)OC)SC1=O

Isomeric SMILES

CCCCCOC(=O)CCCN1C(=S)/C(=C\C2=CC=C(C=C2)OC)/SC1=O

InChI

InChI=1S/C20H25NO4S2/c1-3-4-5-13-25-18(22)7-6-12-21-19(26)17(27-20(21)23)14-15-8-10-16(24-2)11-9-15/h8-11,14H,3-7,12-13H2,1-2H3/b17-14+