JA8
Summary
| Name: | 5-bromanyl-1,3-benzothiazol-2-amine |
| Formula: | C7 H5 Br N2 S |
| Formal charge: | 0 |
| Formula weight: | 229.097 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 5-bromanyl-1,3-benzothiazol-2-amine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C7H5BrN2S/c8-4-1-2-6-5(3-4)10-7(9)11-6/h1-3H,(H2,9,10) |
| InChIKey | InChI | 1.03 | ZPUJTWBWSOOMRP-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Nc1sc2ccc(Br)cc2n1 |
| SMILES | CACTVS | 3.385 | Nc1sc2ccc(Br)cc2n1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc2c(cc1Br)nc(s2)N |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1cc2c(cc1Br)nc(s2)N |
