4GY
Summary
| Name: | 4-amino-N-(cyclohexylmethyl)-1,2,5-oxadiazole-3-carboxamide |
| Formula: | C10 H16 N4 O2 |
| Formal charge: | 0 |
| Formula weight: | 224.26 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 4-amino-N-(cyclohexylmethyl)-1,2,5-oxadiazole-3-carboxamide |
| OpenEye OEToolkits | 1.9.2 | 4-azanyl-N-(cyclohexylmethyl)-1,2,5-oxadiazole-3-carboxamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | Nc1nonc1C(=O)NCC2CCCCC2 |
| InChI | InChI | 1.03 | InChI=1S/C10H16N4O2/c11-9-8(13-16-14-9)10(15)12-6-7-4-2-1-3-5-7/h7H,1-6H2,(H2,11,14)(H,12,15) |
| InChIKey | InChI | 1.03 | LMUMGZXENBDFGR-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Nc1nonc1C(=O)NCC2CCCCC2 |
| SMILES | CACTVS | 3.385 | Nc1nonc1C(=O)NCC2CCCCC2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | C1CCC(CC1)CNC(=O)c2c(non2)N |
| SMILES | OpenEye OEToolkits | 1.9.2 | C1CCC(CC1)CNC(=O)c2c(non2)N |
