V1Q
Summary
| Name: | 4-methyl-~{N}-(1-methylpyrazol-3-yl)benzenesulfonamide |
| Formula: | C11 H13 N3 O2 S |
| Formal charge: | 0 |
| Formula weight: | 251.305 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 4-methyl-~{N}-(1-methylpyrazol-3-yl)benzenesulfonamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C11H13N3O2S/c1-9-3-5-10(6-4-9)17(15,16)13-11-7-8-14(2)12-11/h3-8H,1-2H3,(H,12,13) |
| InChIKey | InChI | 1.03 | TWGSHKAINVZRCA-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cn1ccc(N[S](=O)(=O)c2ccc(C)cc2)n1 |
| SMILES | CACTVS | 3.385 | Cn1ccc(N[S](=O)(=O)c2ccc(C)cc2)n1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cc1ccc(cc1)S(=O)(=O)Nc2ccn(n2)C |
| SMILES | OpenEye OEToolkits | 2.0.7 | Cc1ccc(cc1)S(=O)(=O)Nc2ccn(n2)C |
