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

Systemtic Name: 4-[3-[(5E)-5-[(4-methoxyphenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoylamino]butanoate Openeye Name: 4-[3-[(5E)-5-[(4-methoxyphenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]propanoylamino]butanoate CAS Name: 4-[[3-[(5E)-5-[(4-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]-1-oxopropyl]amino]butanoate IUPAC Name: 4-[3-[(5E)-5-[(4-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoylamino]butanoate Traditional Name: 4-[3-[(5E)-4-keto-5-p-anisylidene-2-thioxo-thiazolidin-3-yl]propanoylamino]butyrate Formula: C18H19N2O5S2- MolecularWeight: 407.48386

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C=C2C(=O)N(C(=S)S2)CCC(=O)NCCCC(=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)/C=C/2\C(=O)N(C(=S)S2)CCC(=O)NCCCC(=O)[O-]

InChI

InChI=1S/C18H20N2O5S2/c1-25-13-6-4-12(5-7-13)11-14-17(24)20(18(26)27-14)10-8-15(21)19-9-2-3-16(22)23/h4-7,11H,2-3,8-10H2,1H3,(H,19,21)(H,22,23)/p-1/b14-11+