EUH
Summary
Name: | 6-(trifluoromethylsulfanyl)-1,3-benzothiazol-2-amine |
Formula: | C8 H5 F3 N2 S2 |
Formal charge: | 0 |
Formula weight: | 250.264 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.6 | 6-(trifluoromethylsulfanyl)-1,3-benzothiazol-2-amine |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C8H5F3N2S2/c9-8(10,11)15-4-1-2-5-6(3-4)14-7(12)13-5/h1-3H,(H2,12,13) |
InChIKey | InChI | 1.03 | PBRVVEXJMLEKMJ-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | Nc1sc2cc(SC(F)(F)F)ccc2n1 |
SMILES | CACTVS | 3.385 | Nc1sc2cc(SC(F)(F)F)ccc2n1 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1cc2c(cc1SC(F)(F)F)sc(n2)N |
SMILES | OpenEye OEToolkits | 2.0.6 | c1cc2c(cc1SC(F)(F)F)sc(n2)N |