O85
Summary
Name: | 3-fluoranyl-~{N}-methyl-~{N}-(2-sulfanylethyl)benzamide |
Formula: | C10 H12 F N O S |
Formal charge: | 0 |
Formula weight: | 213.272 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.7 | 3-fluoranyl-~{N}-methyl-~{N}-(2-sulfanylethyl)benzamide |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C10H12FNOS/c1-12(5-6-14)10(13)8-3-2-4-9(11)7-8/h2-4,7,14H,5-6H2,1H3 |
InChIKey | InChI | 1.03 | LDKKTSNZLWHURK-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CN(CCS)C(=O)c1cccc(F)c1 |
SMILES | CACTVS | 3.385 | CN(CCS)C(=O)c1cccc(F)c1 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CN(CCS)C(=O)c1cccc(c1)F |
SMILES | OpenEye OEToolkits | 2.0.7 | CN(CCS)C(=O)c1cccc(c1)F |