| MolName | N'-[2-[(5Z)-5-benzylidene-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetyl]-2-hydroxybenzohydrazide |
| MolecularFormula | C19H15N3O4S2 |
| Smiles | Oc(cccc1)c1C(NNC(CN(C(/C(/S1)=C/c2ccccc2)=O)C1=S)=O)=O |
| InChI | InChI=1S/C19H15N3O4S2/c23-14-9-5-4-8-13(14)17(25)21-20-16(24)11-22-18(26)15(28-19(22)27)10-12-6-2-1-3-7-12/h1-10,23H,11H2,(H,20,24)(H,21,25) |
| InChIK | OROGCLWOUZBUQB-UHFFFAOYSA-N |
| TotalMolweight | 413.477 |
| Molweight | 413.477 |
| MonoisotopicMass | 413.050397 |
| CLogP | 0.6543 |
| CLogS | -4.298 |
| H Acceptors | 7 |
| H Donors | 3 |
| TotalSurfaceArea | 301.01 |
| Relative PSA | 0.41254 |
| PolarSurfaceArea | 156.13 |
| Druglikeness | 5.2618 |
| Mutagenic | high |
| Tumorigenic | high |
| Reproductive Effective | low |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.60714 |
| Fragments | 1 |
| Non HAtoms | 28 |
| NonCHAtoms | 9 |
| Electronegative Atoms | 9 |
| Rotatable Bond | 5 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 4 |
| Symmetricatoms | 2 |
| Amides | 1 |
| StereoCon |
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1 - N'-[2-[(5Z)-5-benzylidene-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetyl]-2-hydroxybenzohydrazide | 2 - N'-[2-[(5Z)-5-benzylidene-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetyl]-2-hydroxybenzohydrazide