A1IK2
Summary
| Name: | 4-(4-methoxyphenyl)-~{N}-[6-(oxidanylamino)-6-oxidanylidene-hexoxy]-1,3-thiazole-2-carboxamide |
| Formula: | C17 H21 N3 O5 S |
| Formal charge: | 0 |
| Formula weight: | 379.431 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 4-(4-methoxyphenyl)-~{N}-[6-(oxidanylamino)-6-oxidanylidene-hexoxy]-1,3-thiazole-2-carboxamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C17H21N3O5S/c1-24-13-8-6-12(7-9-13)14-11-26-17(18-14)16(22)20-25-10-4-2-3-5-15(21)19-23/h6-9,11,23H,2-5,10H2,1H3,(H,19,21)(H,20,22) |
| InChIKey | InChI | 1.06 | LAFLKLWIJPLLQL-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COc1ccc(cc1)c2csc(n2)C(=O)NOCCCCCC(=O)NO |
| SMILES | CACTVS | 3.385 | COc1ccc(cc1)c2csc(n2)C(=O)NOCCCCCC(=O)NO |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | COc1ccc(cc1)c2csc(n2)C(=O)NOCCCCCC(=O)NO |
| SMILES | OpenEye OEToolkits | 2.0.7 | COc1ccc(cc1)c2csc(n2)C(=O)NOCCCCCC(=O)NO |
