propyl 4-[(5E)-5-[(4-tert-butylphenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate

Systemtic Name: propyl 4-[(5E)-5-[(4-tert-butylphenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate Openeye Name: propyl 4-[(5E)-5-[(4-tert-butylphenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]butanoate CAS Name: 4-[(5E)-5-[(4-tert-butylphenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]butanoic acid propyl ester IUPAC Name: propyl 4-[(5E)-5-[(4-tert-butylphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate Traditional Name: 4-[(5E)-5-(4-tert-butylbenzylidene)-4-keto-2-thioxo-thiazolidin-3-yl]butyric acid propyl ester Formula: C21H27NO3S2 MolecularWeight: 405.57398

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)CCCN1C(=O)C(=CC2=CC=C(C=C2)C(C)(C)C)SC1=S

Isomeric SMILES

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

InChI

InChI=1S/C21H27NO3S2/c1-5-13-25-18(23)7-6-12-22-19(24)17(27-20(22)26)14-15-8-10-16(11-9-15)21(2,3)4/h8-11,14H,5-7,12-13H2,1-4H3/b17-14+