2-[(5E)-4-oxidanylidene-5-[(4-prop-2-enoxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl]pentanoic acid

Systemtic Name: 2-[(5E)-4-oxidanylidene-5-[(4-prop-2-enoxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl]pentanoic acid Openeye Name: 2-[(5E)-5-[(4-allyloxyphenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]pentanoic acid CAS Name: 2-[(5E)-4-oxo-5-[(4-prop-2-enoxyphenyl)methylidene]-2-sulfanylidene-3-thiazolidinyl]pentanoic acid IUPAC Name: 2-[(5E)-4-oxo-5-[(4-prop-2-enoxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl]pentanoic acid Traditional Name: 2-[(5E)-5-(4-allyloxybenzylidene)-4-keto-2-thioxo-thiazolidin-3-yl]valeric acid Formula: C18H19NO4S2 MolecularWeight: 377.47776

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)O)N1C(=O)C(=CC2=CC=C(C=C2)OCC=C)SC1=S

Isomeric SMILES

CCCC(C(=O)O)N1C(=O)/C(=C\C2=CC=C(C=C2)OCC=C)/SC1=S

InChI

InChI=1S/C18H19NO4S2/c1-3-5-14(17(21)22)19-16(20)15(25-18(19)24)11-12-6-8-13(9-7-12)23-10-4-2/h4,6-9,11,14H,2-3,5,10H2,1H3,(H,21,22)/b15-11+