A1IIA
Summary
| Name: | (1S)-3-(methylamino)-1-thiophen-2-yl-propan-1-ol |
| Formula: | C8 H13 N O S |
| Formal charge: | 0 |
| Formula weight: | 171.26 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | (1~{S})-3-(methylamino)-1-thiophen-2-yl-propan-1-ol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C8H13NOS/c1-9-5-4-7(10)8-3-2-6-11-8/h2-3,6-7,9-10H,4-5H2,1H3/t7-/m0/s1 |
| InChIKey | InChI | 1.06 | YEJVVFOJMOHFRL-ZETCQYMHSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CNCC[C@H](O)c1sccc1 |
| SMILES | CACTVS | 3.385 | CNCC[CH](O)c1sccc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CNCC[C@@H](c1cccs1)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | CNCCC(c1cccs1)O |
