6Y3
Summary
| Name: | ~{N}-(4-aminophenyl)-2-selanyl-benzamide |
| Synonyms: | amino-ebselen (open form) |
| Formula: | C13 H12 N2 O Se |
| Formal charge: | 0 |
| Formula weight: | 291.207 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.5 | ~{N}-(4-aminophenyl)-2-selanyl-benzamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C13H12N2OSe/c14-9-5-7-10(8-6-9)15-13(16)11-3-1-2-4-12(11)17/h1-8,17H,14H2,(H,15,16) |
| InChIKey | InChI | 1.03 | MAEAMJWLVXANNO-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Nc1ccc(NC(=O)c2ccccc2[SeH])cc1 |
| SMILES | CACTVS | 3.385 | Nc1ccc(NC(=O)c2ccccc2[SeH])cc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.5 | c1ccc(c(c1)C(=O)Nc2ccc(cc2)N)[SeH] |
| SMILES | OpenEye OEToolkits | 2.0.5 | c1ccc(c(c1)C(=O)Nc2ccc(cc2)N)[SeH] |
