AM4
Summary
| Name: | 4-(METHYLSULFONYL)BENZENECARBOXIMIDAMIDE |
| Formula: | C8 H10 N2 O2 S |
| Formal charge: | 0 |
| Formula weight: | 198.242 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 4-(methylsulfonyl)benzenecarboximidamide |
| OpenEye OEToolkits | 1.5.0 | 4-methylsulfonylbenzenecarboximidamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=S(=O)(c1ccc(C(=[N@H])N)cc1)C |
| SMILES_CANONICAL | CACTVS | 3.341 | C[S](=O)(=O)c1ccc(cc1)C(N)=N |
| SMILES | CACTVS | 3.341 | C[S](=O)(=O)c1ccc(cc1)C(N)=N |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CS(=O)(=O)c1ccc(cc1)C(=N)N |
| SMILES | OpenEye OEToolkits | 1.5.0 | CS(=O)(=O)c1ccc(cc1)C(=N)N |
| InChI | InChI | 1.03 | InChI=1S/C8H10N2O2S/c1-13(11,12)7-4-2-6(3-5-7)8(9)10/h2-5H,1H3,(H3,9,10) |
| InChIKey | InChI | 1.03 | ANPBNAUKOUYEGJ-UHFFFAOYSA-N |
