U9C
Summary
| Name: | ~{N}6-(4-aminophenyl)-1,2-benzothiazole-3,6-diamine |
| Formula: | C13 H12 N4 S |
| Formal charge: | 0 |
| Formula weight: | 256.326 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | ~{N}6-(4-aminophenyl)-1,2-benzothiazole-3,6-diamine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C13H12N4S/c14-8-1-3-9(4-2-8)16-10-5-6-11-12(7-10)18-17-13(11)15/h1-7,16H,14H2,(H2,15,17) |
| InChIKey | InChI | 1.06 | FECJVFNLOHROBQ-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Nc1ccc(Nc2ccc3c(N)nsc3c2)cc1 |
| SMILES | CACTVS | 3.385 | Nc1ccc(Nc2ccc3c(N)nsc3c2)cc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc(ccc1N)Nc2ccc3c(c2)snc3N |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(ccc1N)Nc2ccc3c(c2)snc3N |
