2-[(5Z)-5-[(5-chloranyl-2-pentoxy-phenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanoic acid

Systemtic Name: 2-[(5Z)-5-[(5-chloranyl-2-pentoxy-phenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanoic acid Openeye Name: 2-[(5Z)-5-[(5-chloro-2-pentoxy-phenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]acetic acid CAS Name: 2-[(5Z)-5-[(5-chloro-2-pentoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]acetic acid IUPAC Name: 2-[(5Z)-5-[(5-chloro-2-pentoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid Traditional Name: 2-[(5Z)-5-(2-amoxy-5-chloro-benzylidene)-4-keto-2-thioxo-thiazolidin-3-yl]acetic acid Formula: C17H18ClNO4S2 MolecularWeight: 399.91212

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=C(C=C1)Cl)C=C2C(=O)N(C(=S)S2)CC(=O)O

Isomeric SMILES

CCCCCOC1=C(C=C(C=C1)Cl)/C=C\2/C(=O)N(C(=S)S2)CC(=O)O

InChI

InChI=1S/C17H18ClNO4S2/c1-2-3-4-7-23-13-6-5-12(18)8-11(13)9-14-16(22)19(10-15(20)21)17(24)25-14/h5-6,8-9H,2-4,7,10H2,1H3,(H,20,21)/b14-9-