Z07
Summary
| Name: | 4-(trifluoromethyl)-1,3-benzothiazol-2-amine |
| Formula: | C8 H5 F3 N2 S |
| Formal charge: | 0 |
| Formula weight: | 218.199 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 4-(trifluoromethyl)-1,3-benzothiazol-2-amine |
| OpenEye OEToolkits | 2.0.7 | 4-(trifluoromethyl)-1,3-benzothiazol-2-amine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | FC(F)(F)c1cccc2sc(N)nc12 |
| InChI | InChI | 1.03 | InChI=1S/C8H5F3N2S/c9-8(10,11)4-2-1-3-5-6(4)13-7(12)14-5/h1-3H,(H2,12,13) |
| InChIKey | InChI | 1.03 | FGZBTCDIPNGYRC-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Nc1sc2cccc(c2n1)C(F)(F)F |
| SMILES | CACTVS | 3.385 | Nc1sc2cccc(c2n1)C(F)(F)F |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc(c2c(c1)sc(n2)N)C(F)(F)F |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(c2c(c1)sc(n2)N)C(F)(F)F |
