M58
Summary
| Name: | (~{R})-azanyl(pyridin-3-yl)methanethiol |
| Formula: | C6 H8 N2 S |
| Formal charge: | 0 |
| Formula weight: | 140.206 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | (~{R})-azanyl(pyridin-3-yl)methanethiol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C6H8N2S/c7-6(9)5-2-1-3-8-4-5/h1-4,6,9H,7H2/t6-/m1/s1 |
| InChIKey | InChI | 1.03 | FNWRZJSHJIXOOI-ZCFIWIBFSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | N[C@H](S)c1cccnc1 |
| SMILES | CACTVS | 3.385 | N[CH](S)c1cccnc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc(cnc1)[C@H](N)S |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(cnc1)C(N)S |
