AC1NWM6Z
2-[(5Z)-5-[(4-chlorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-3-methylbutanoic acid
Also Known As: BAS 00777968|AB00079093-01|AE-641/10049040|2-[5-(4-chlorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-3-methylbutanoic acid|2-[(5Z)-5-[(4-chlorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-3-methylbutanoic acid|2-{5-[(4-chlorophenyl)methylene]-4-oxo-2-thioxo(1,3-thiazolidin-3-yl)}-3-methy lbutanoic acid
| Molecular Formula | C15H14ClNO3S2 |
|---|---|
| Molecular Weight | 355.01038 g/mol |
| LogP | 3.6504 |
| Topological Polar Surface Area | 57.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 355.01038 |
| Monoisotopic Mass | 355.01038 |
| Heavy Atoms | 22 |
| Complexity | 655.25635 |
Chemical Identifiers
| CAS Number | 6593-73-3 |
|---|---|
| SMILES | CC(C)C(C(=O)O)N1C(=O)/C(=C/C2=CC=C(C=C2)Cl)/SC1=S |
Product Overview
AC1NWM6Z (CAS 6593-73-3), with molecular formula C15H14ClNO3S2 and molecular weight 355.01038 g/mol. IUPAC: 2-[(5Z)-5-[(4-chlorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-3-methylbutanoic acid.
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