7CB
Summary
| Name: | isoquinoline-5-sulfonamide |
| Formula: | C9 H8 N2 O2 S |
| Formal charge: | 0 |
| Formula weight: | 208.237 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | isoquinoline-5-sulfonamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C9H8N2O2S/c10-14(12,13)9-3-1-2-7-6-11-5-4-8(7)9/h1-6H,(H2,10,12,13) |
| InChIKey | InChI | 1.03 | BFIWZEKPARJYJE-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | N[S](=O)(=O)c1cccc2cnccc12 |
| SMILES | CACTVS | 3.385 | N[S](=O)(=O)c1cccc2cnccc12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1cc2cnccc2c(c1)S(=O)(=O)N |
| SMILES | OpenEye OEToolkits | 2.0.6 | c1cc2cnccc2c(c1)S(=O)(=O)N |
