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

Systemtic Name: propyl 4-[(5E)-5-[(3-butoxyphenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate Openeye Name: propyl 4-[(5E)-5-[(3-butoxyphenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]butanoate CAS Name: 4-[(5E)-5-[(3-butoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]butanoic acid propyl ester IUPAC Name: propyl 4-[(5E)-5-[(3-butoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate Traditional Name: 4-[(5E)-5-(3-butoxybenzylidene)-4-keto-2-thioxo-thiazolidin-3-yl]butyric acid propyl ester Formula: C21H27NO4S2 MolecularWeight: 421.57338

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C=C2C(=O)N(C(=S)S2)CCCC(=O)OCCC

Isomeric SMILES

CCCCOC1=CC=CC(=C1)/C=C/2\C(=O)N(C(=S)S2)CCCC(=O)OCCC

InChI

InChI=1S/C21H27NO4S2/c1-3-5-13-25-17-9-6-8-16(14-17)15-18-20(24)22(21(27)28-18)11-7-10-19(23)26-12-4-2/h6,8-9,14-15H,3-5,7,10-13H2,1-2H3/b18-15+