L5L
Summary
| Name: | (4R)-4-(4-methoxyphenyl)-4,5,6,7-tetrahydrothieno[3,2-c]pyridine |
| Formula: | C14 H15 N O S |
| Formal charge: | 0 |
| Formula weight: | 245.34 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (4R)-4-(4-methoxyphenyl)-4,5,6,7-tetrahydrothieno[3,2-c]pyridine |
| OpenEye OEToolkits | 2.0.7 | (4~{R})-4-(4-methoxyphenyl)-4,5,6,7-tetrahydrothieno[3,2-c]pyridine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | COc1ccc(cc1)C1NCCc2sccc21 |
| InChI | InChI | 1.03 | InChI=1S/C14H15NOS/c1-16-11-4-2-10(3-5-11)14-12-7-9-17-13(12)6-8-15-14/h2-5,7,9,14-15H,6,8H2,1H3/t14-/m1/s1 |
| InChIKey | InChI | 1.03 | YZMKEDMYYJQGRD-CQSZACIVSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COc1ccc(cc1)[C@H]2NCCc3sccc23 |
| SMILES | CACTVS | 3.385 | COc1ccc(cc1)[CH]2NCCc3sccc23 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | COc1ccc(cc1)[C@@H]2c3ccsc3CCN2 |
| SMILES | OpenEye OEToolkits | 2.0.7 | COc1ccc(cc1)C2c3ccsc3CCN2 |
