YC5
Summary
Name: | 4-azanyl-3-fluoranyl-benzenethiol |
Formula: | C6 H6 F N S |
Formal charge: | 0 |
Formula weight: | 143.182 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.7 | 4-azanyl-3-fluoranyl-benzenethiol |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.06 | InChI=1S/C6H6FNS/c7-5-3-4(9)1-2-6(5)8/h1-3,9H,8H2 |
InChIKey | InChI | 1.06 | MAOWDGRYXPTHRM-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | Nc1ccc(S)cc1F |
SMILES | CACTVS | 3.385 | Nc1ccc(S)cc1F |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc(c(cc1S)F)N |
SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(c(cc1S)F)N |