IUU
Summary
| Name: | 4-Amino-N-(3-chloro-4-fluorophenyl)-N'-hydroxy-1,2,5-oxadiazole-3-carboxamidine |
| Formula: | C9 H7 Cl F N5 O2 |
| Formal charge: | 0 |
| Formula weight: | 271.636 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | 4-azanyl-~{N}-(3-chloranyl-4-fluoranyl-phenyl)-~{N}'-oxidanyl-1,2,5-oxadiazole-3-carboximidamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C9H7ClFN5O2/c10-5-3-4(1-2-6(5)11)13-9(14-17)7-8(12)16-18-15-7/h1-3,17H,(H2,12,16)(H,13,14) |
| InChIKey | InChI | 1.03 | HGXSLPIXNPASGZ-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Nc1nonc1C(/Nc2ccc(F)c(Cl)c2)=N\O |
| SMILES | CACTVS | 3.385 | Nc1nonc1C(Nc2ccc(F)c(Cl)c2)=NO |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1cc(c(cc1N/C(=N/O)/c2c(non2)N)Cl)F |
| SMILES | OpenEye OEToolkits | 2.0.6 | c1cc(c(cc1NC(=NO)c2c(non2)N)Cl)F |
