| MolName | (5Z)-3-(furan-2-ylmethyl)-5-[[4-[(2-methylphenyl)methoxy]phenyl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one |
| MolecularFormula | C23H19NO3S2 |
| Smiles | Cc1c(COc2ccc(/C=C(/C(N3Cc4ccco4)=O)\SC3=S)cc2)cccc1 |
| InChI | InChI=1S/C23H19NO3S2/c1-16-5-2-3-6-18(16)15-27-19-10-8-17(9-11-19)13-21-22(25)24(23(28)29-21)14-20-7-4-12-26-20/h2-13H,14-15H2,1H3 |
| InChIK | PFSGPACQMXPRCU-UHFFFAOYSA-N |
| TotalMolweight | 421.54 |
| Molweight | 421.54 |
| MonoisotopicMass | 421.080634 |
| CLogP | 3.6959 |
| CLogS | -5.828 |
| H Acceptors | 4 |
| TotalSurfaceArea | 321.71 |
| Relative PSA | 0.26791 |
| PolarSurfaceArea | 100.07 |
| Druglikeness | 3.6013 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.62069 |
| Fragments | 1 |
| Non HAtoms | 29 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 6 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 17 |
| Sp3Atoms | 6 |
| Symmetricatoms | 2 |
| Amides | 1 |
| StereoCon |
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1 - (5Z)-3-(furan-2-ylmethyl)-5-[[4-[(2-methylphenyl)methoxy]phenyl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one | 2 - (5Z)-3-(furan-2-ylmethyl)-5-[[4-[(2-methylphenyl)methoxy]phenyl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one