692
Summary
| Name: | N-methyl-1-(2-thiophen-2-ylphenyl)methanamine |
| Formula: | C12 H13 N S |
| Formal charge: | 0 |
| Formula weight: | 203.303 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | N-methyl-1-(2-thiophen-2-ylphenyl)methanamine |
| OpenEye OEToolkits | 1.5.0 | N-methyl-1-(2-thiophen-2-ylphenyl)methanamine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | s2c(c1c(cccc1)CNC)ccc2 |
| SMILES_CANONICAL | CACTVS | 3.341 | CNCc1ccccc1c2sccc2 |
| SMILES | CACTVS | 3.341 | CNCc1ccccc1c2sccc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CNCc1ccccc1c2cccs2 |
| SMILES | OpenEye OEToolkits | 1.5.0 | CNCc1ccccc1c2cccs2 |
| InChI | InChI | 1.03 | InChI=1S/C12H13NS/c1-13-9-10-5-2-3-6-11(10)12-7-4-8-14-12/h2-8,13H,9H2,1H3 |
| InChIKey | InChI | 1.03 | MRKJJEJYTBOUTH-UHFFFAOYSA-N |
