Epalrestat
Properties
- Molecular formula
- C15H13NO3S2
- Molar mass
- 319.39 g/mol
- Exact mass
- 319.0337 Da
- Melting point
- 210–217 °C
- logP
- 2.92Crippen estimate
- Polar surface area
- 57.6 Ų
- H-bond donors / acceptors
- 1 / 4
- Rotatable bonds
- 4
Identifiers
CAS number
82159-09-9SMILES
CC(/C=C1SC(=S)N(CC(=O)O)C1=O)=Cc1ccccc1InChIKey
CHNUOJQWGUIOLD-NFZZJPOKSA-NInChI
InChI=1S/C15H13NO3S2/c1-10(7-11-5-3-2-4-6-11)8-12-14(19)16(9-13(17)18)15(20)21-12/h2-8H,9H2,1H3,(H,17,18)/b10-7+,12-8-Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
9 names
- 3-Thiazolidineacetic acid, 5-[(2E)-2-methyl-3-phenyl-2-propen-1-ylidene]-4-oxo-2-thioxo-, (5Z)-
- 3-Thiazolidineacetic acid, 5-(2-methyl-3-phenyl-2-propenylidene)-4-oxo-2-thioxo-, (Z,E)-
- 3-Thiazolidineacetic acid, 5-[(2E)-2-methyl-3-phenyl-2-propenylidene]-4-oxo-2-thioxo-, (5Z)-
- (5Z)-5-[(2E)-2-Methyl-3-phenyl-2-propen-1-ylidene]-4-oxo-2-thioxo-3-thiazolidineacetic acid
- ONO 2235
- Kinedak
- Sorbistat
- Eabeth
- 2-[(Z)-5-((E)-2-Methyl-3-phenylallylidene)-4-oxo-2-thioxothiazolidin-3-yl]acetic acid
Work with Epalrestat
Similar compounds
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α-Methylcinnamaldehyde101-39-335 % similar
N-Phenyliminodiacetic acid1137-73-134 % similar
α-Methylcinnamic acid1199-77-533 % similar
N-(Carboxymethyl)-N-(phenylmethyl)glycine3987-53-933 % similar
N-Methyl-N-[(phenylmethoxy)carbonyl]glycine39608-31-632 % similar
Alrestatin51411-04-232 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds