4FV
Summary
| Name: | 4-amino-N-[(1R,3S)-3-hydroxycyclopentyl]-1,2,5-oxadiazole-3-carboxamide |
| Formula: | C8 H12 N4 O3 |
| Formal charge: | 0 |
| Formula weight: | 212.206 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 4-amino-N-[(1R,3S)-3-hydroxycyclopentyl]-1,2,5-oxadiazole-3-carboxamide |
| OpenEye OEToolkits | 1.9.2 | 4-azanyl-N-[(1R,3S)-3-oxidanylcyclopentyl]-1,2,5-oxadiazole-3-carboxamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | c1(c(non1)N)C(=O)NC2CCC(C2)O |
| InChI | InChI | 1.03 | InChI=1S/C8H12N4O3/c9-7-6(11-15-12-7)8(14)10-4-1-2-5(13)3-4/h4-5,13H,1-3H2,(H2,9,12)(H,10,14)/t4-,5+/m1/s1 |
| InChIKey | InChI | 1.03 | UDKGUOUTPCVPOO-UHNVWZDZSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Nc1nonc1C(=O)N[C@@H]2CC[C@H](O)C2 |
| SMILES | CACTVS | 3.385 | Nc1nonc1C(=O)N[CH]2CC[CH](O)C2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | C1C[C@@H](C[C@@H]1NC(=O)c2c(non2)N)O |
| SMILES | OpenEye OEToolkits | 1.9.2 | C1CC(CC1NC(=O)c2c(non2)N)O |
