80G
Summary
| Name: | 1-(4-thiophen-2-ylphenyl)methanamine |
| Formula: | C11 H11 N S |
| Formal charge: | 0 |
| Formula weight: | 189.277 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 1-(4-thiophen-2-ylphenyl)methanamine |
| OpenEye OEToolkits | 1.5.0 | (4-thiophen-2-ylphenyl)methanamine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | s2c(c1ccc(cc1)CN)ccc2 |
| SMILES_CANONICAL | CACTVS | 3.341 | NCc1ccc(cc1)c2sccc2 |
| SMILES | CACTVS | 3.341 | NCc1ccc(cc1)c2sccc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1cc(sc1)c2ccc(cc2)CN |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1cc(sc1)c2ccc(cc2)CN |
| InChI | InChI | 1.03 | InChI=1S/C11H11NS/c12-8-9-3-5-10(6-4-9)11-2-1-7-13-11/h1-7H,8,12H2 |
| InChIKey | InChI | 1.03 | YKNLMMDEWQZCLJ-UHFFFAOYSA-N |
