VTK
Summary
| Name: | 2-[methyl(methylsulfonyl)amino]-~{N}-(4-piperidin-1-ylsulfonylphenyl)benzamide |
| Formula: | C20 H25 N3 O5 S2 |
| Formal charge: | 0 |
| Formula weight: | 451.56 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 2-[methyl(methylsulfonyl)amino]-~{N}-(4-piperidin-1-ylsulfonylphenyl)benzamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C20H25N3O5S2/c1-22(29(2,25)26)19-9-5-4-8-18(19)20(24)21-16-10-12-17(13-11-16)30(27,28)23-14-6-3-7-15-23/h4-5,8-13H,3,6-7,14-15H2,1-2H3,(H,21,24) |
| InChIKey | InChI | 1.06 | WMMQKHOYQUOGHM-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CN(c1ccccc1C(=O)Nc2ccc(cc2)[S](=O)(=O)N3CCCCC3)[S](C)(=O)=O |
| SMILES | CACTVS | 3.385 | CN(c1ccccc1C(=O)Nc2ccc(cc2)[S](=O)(=O)N3CCCCC3)[S](C)(=O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CN(c1ccccc1C(=O)Nc2ccc(cc2)S(=O)(=O)N3CCCCC3)S(=O)(=O)C |
| SMILES | OpenEye OEToolkits | 2.0.7 | CN(c1ccccc1C(=O)Nc2ccc(cc2)S(=O)(=O)N3CCCCC3)S(=O)(=O)C |
