4-[(5Z)-5-[(8-methoxy-2H-chromen-3-yl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoic acid

Systemtic Name: 4-[(5Z)-5-[(8-methoxy-2H-chromen-3-yl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoic acid Openeye Name: 4-[(5Z)-5-[(8-methoxy-2H-chromen-3-yl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]butanoic acid CAS Name: 4-[(5Z)-5-[(8-methoxy-2H-1-benzopyran-3-yl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]butanoic acid IUPAC Name: 4-[(5Z)-5-[(8-methoxy-2H-chromen-3-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoic acid Traditional Name: 4-[(5Z)-4-keto-5-[(8-methoxy-2H-chromen-3-yl)methylene]-2-thioxo-thiazolidin-3-yl]butyric acid Formula: C18H17NO5S2 MolecularWeight: 391.46128

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1OCC(=C2)C=C3C(=O)N(C(=S)S3)CCCC(=O)O

Isomeric SMILES

COC1=CC=CC2=C1OCC(=C2)/C=C\3/C(=O)N(C(=S)S3)CCCC(=O)O

InChI

InChI=1S/C18H17NO5S2/c1-23-13-5-2-4-12-8-11(10-24-16(12)13)9-14-17(22)19(18(25)26-14)7-3-6-15(20)21/h2,4-5,8-9H,3,6-7,10H2,1H3,(H,20,21)/b14-9-