| MolName | (5Z)-5-[(4-morpholin-4-ylphenyl)methylidene]-3-phenyl-2-sulfanylidene-1,3-thiazolidin-4-one |
| MolecularFormula | C20H18N2O2S2 |
| Smiles | O=C(/C(/SC1=S)=C/c(cc2)ccc2N2CCOCC2)N1c1ccccc1 |
| InChI | InChI=1S/C20H18N2O2S2/c23-19-18(26-20(25)22(19)17-4-2-1-3-5-17)14-15-6-8-16(9-7-15)21-10-12-24-13-11-21/h1-9,14H,10-13H2 |
| InChIK | NSXHZFZGHPTBKF-UHFFFAOYSA-N |
| TotalMolweight | 382.507 |
| Molweight | 382.507 |
| MonoisotopicMass | 382.080968 |
| CLogP | 2.5613 |
| CLogS | -5.086 |
| H Acceptors | 4 |
| TotalSurfaceArea | 284.32 |
| Relative PSA | 0.266 |
| PolarSurfaceArea | 90.17 |
| Druglikeness | 3.2647 |
| Mutagenic | high |
| Tumorigenic | low |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.61538 |
| Fragments | 1 |
| Non HAtoms | 26 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 3 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 7 |
| Symmetricatoms | 6 |
| Amides | 1 |
| Amines | 1 |
| Aromatic Amines | 1 |
| StereoCon |
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1 - (5Z)-5-[(4-morpholin-4-ylphenyl)methylidene]-3-phenyl-2-sulfanylidene-1,3-thiazolidin-4-one | 2 - (5Z)-5-[(4-morpholin-4-ylphenyl)methylidene]-3-phenyl-2-sulfanylidene-1,3-thiazolidin-4-one