BM8
Summary
| Name: | 4-(1,3-benzothiazol-2-yl)-2-methyl-aniline |
| Formula: | C14 H12 N2 S |
| Formal charge: | 0 |
| Formula weight: | 240.323 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | 4-(1,3-benzothiazol-2-yl)-2-methyl-aniline |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C14H12N2S/c1-9-8-10(6-7-11(9)15)14-16-12-4-2-3-5-13(12)17-14/h2-8H,15H2,1H3 |
| InChIKey | InChI | 1.03 | IDBCUMFOZBUJCL-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cc1cc(ccc1N)c2sc3ccccc3n2 |
| SMILES | CACTVS | 3.385 | Cc1cc(ccc1N)c2sc3ccccc3n2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | Cc1cc(ccc1N)c2nc3ccccc3s2 |
| SMILES | OpenEye OEToolkits | 2.0.6 | Cc1cc(ccc1N)c2nc3ccccc3s2 |
