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

Systemtic Name: 4-[(5E)-5-[(4-cyanophenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate Openeye Name: 4-[(5E)-5-[(4-cyanophenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]butanoate CAS Name: 4-[(5E)-5-[(4-cyanophenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]butanoate IUPAC Name: 4-[(5E)-5-[(4-cyanophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate Traditional Name: 4-[(5E)-5-(4-cyanobenzylidene)-4-keto-2-thioxo-thiazolidin-3-yl]butyrate Formula: C15H11N2O3S2- MolecularWeight: 331.38944

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=C2C(=O)N(C(=S)S2)CCCC(=O)[O-])C#N

Isomeric SMILES

C1=CC(=CC=C1/C=C/2\C(=O)N(C(=S)S2)CCCC(=O)[O-])C#N

InChI

InChI=1S/C15H12N2O3S2/c16-9-11-5-3-10(4-6-11)8-12-14(20)17(15(21)22-12)7-1-2-13(18)19/h3-6,8H,1-2,7H2,(H,18,19)/p-1/b12-8+