UKV
Summary
| Name: | (5Z)-5-[(3-methoxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one |
| Formula: | C11 H9 N O2 S2 |
| Formal charge: | 0 |
| Formula weight: | 251.325 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (5Z)-5-[(3-methoxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one |
| OpenEye OEToolkits | 2.0.7 | (5~{Z})-5-[(3-methoxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | COc2cccc([C@H]=C1C(NC(S1)=S)=O)c2 |
| InChI | InChI | 1.03 | InChI=1S/C11H9NO2S2/c1-14-8-4-2-3-7(5-8)6-9-10(13)12-11(15)16-9/h2-6H,1H3,(H,12,13,15)/b9-6- |
| InChIKey | InChI | 1.03 | ZXBRDIMYFRPBGK-TWGQIWQCSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COc1cccc(c1)/C=C/2SC(=S)NC/2=O |
| SMILES | CACTVS | 3.385 | COc1cccc(c1)C=C2SC(=S)NC2=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | COc1cccc(c1)/C=C\2/C(=O)NC(=S)S2 |
| SMILES | OpenEye OEToolkits | 2.0.7 | COc1cccc(c1)C=C2C(=O)NC(=S)S2 |
