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

Systemtic Name: propyl 4-[(5E)-5-[(2-butoxyphenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate Openeye Name: propyl 4-[(5E)-5-[(2-butoxyphenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]butanoate CAS Name: 4-[(5E)-5-[(2-butoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]butanoic acid propyl ester IUPAC Name: propyl 4-[(5E)-5-[(2-butoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate Traditional Name: 4-[(5E)-5-(2-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=C1C=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/c1-3-5-14-25-17-10-7-6-9-16(17)15-18-20(24)22(21(27)28-18)12-8-11-19(23)26-13-4-2/h6-7,9-10,15H,3-5,8,11-14H2,1-2H3/b18-15+