JFX
Summary
| Name: | 4-fluoro-N-(3-methyl-1H-indazol-5-yl)butane-1-sulfonamide |
| Formula: | C12 H16 F N3 O2 S |
| Formal charge: | 0 |
| Formula weight: | 285.338 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 4-fluoro-N-(3-methyl-1H-indazol-5-yl)butane-1-sulfonamide |
| OpenEye OEToolkits | 2.0.7 | 4-fluoranyl-~{N}-(3-methyl-1~{H}-indazol-5-yl)butane-1-sulfonamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | Cc2c1c(ccc(c1)NS(CCCCF)(=O)=O)nn2 |
| InChI | InChI | 1.03 | InChI=1S/C12H16FN3O2S/c1-9-11-8-10(4-5-12(11)15-14-9)16-19(17,18)7-3-2-6-13/h4-5,8,16H,2-3,6-7H2,1H3,(H,14,15) |
| InChIKey | InChI | 1.03 | AHVAAGWAEHSRBU-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cc1n[nH]c2ccc(N[S](=O)(=O)CCCCF)cc12 |
| SMILES | CACTVS | 3.385 | Cc1n[nH]c2ccc(N[S](=O)(=O)CCCCF)cc12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cc1c2cc(ccc2[nH]n1)NS(=O)(=O)CCCCF |
| SMILES | OpenEye OEToolkits | 2.0.7 | Cc1c2cc(ccc2[nH]n1)NS(=O)(=O)CCCCF |
