HG0
Summary
| Name: | N-[bis(azanyl)methylidene]-3-methylsulfonyl-4-propan-2-yl-benzamide |
| Formula: | C12 H17 N3 O3 S |
| Formal charge: | 0 |
| Formula weight: | 283.347 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | ~{N}-[bis(azanyl)methylidene]-3-methylsulfonyl-4-propan-2-yl-benzamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C12H17N3O3S/c1-7(2)9-5-4-8(11(16)15-12(13)14)6-10(9)19(3,17)18/h4-7H,1-3H3,(H4,13,14,15,16) |
| InChIKey | InChI | 1.03 | IWXNYAIICFKCTM-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC(C)c1ccc(cc1[S](C)(=O)=O)C(=O)N=C(N)N |
| SMILES | CACTVS | 3.385 | CC(C)c1ccc(cc1[S](C)(=O)=O)C(=O)N=C(N)N |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CC(C)c1ccc(cc1S(=O)(=O)C)C(=O)N=C(N)N |
| SMILES | OpenEye OEToolkits | 2.0.7 | CC(C)c1ccc(cc1S(=O)(=O)C)C(=O)N=C(N)N |
