| MolName | (5Z)-3-(3,4-dichlorophenyl)-5-(naphthalen-1-ylmethylidene)-2-sulfanylidene-1,3-thiazolidin-4-one |
| MolecularFormula | C20H11NOCl2S2 |
| Smiles | O=C(/C(/SC1=S)=C/c2cccc3ccccc23)N1c(cc1)cc(Cl)c1Cl |
| InChI | InChI=1S/C20H11Cl2NOS2/c21-16-9-8-14(11-17(16)22)23-19(24)18(26-20(23)25)10-13-6-3-5-12-4-1-2-7-15(12)13/h1-11H |
| InChIK | QSPFLYRRHVKOST-UHFFFAOYSA-N |
| TotalMolweight | 416.351 |
| Molweight | 416.351 |
| MonoisotopicMass | 414.965908 |
| CLogP | 5.2987 |
| CLogS | -8.061 |
| H Acceptors | 2 |
| TotalSurfaceArea | 287.92 |
| Relative PSA | 0.21562 |
| PolarSurfaceArea | 77.7 |
| Druglikeness | 2.8296 |
| Mutagenic | none |
| Tumorigenic | high |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.53846 |
| Fragments | 1 |
| Non HAtoms | 26 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 2 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 16 |
| Sp3Atoms | 2 |
| Amides | 1 |
| StereoCon |
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1 - (5Z)-3-(3,4-dichlorophenyl)-5-(naphthalen-1-ylmethylidene)-2-sulfanylidene-1,3-thiazolidin-4-one | 2 - (5Z)-3-(3,4-dichlorophenyl)-5-(naphthalen-1-ylmethylidene)-2-sulfanylidene-1,3-thiazolidin-4-one