W1J
Summary
| Name: | N-(2-propyl-2H-tetrazol-5-yl)furan-2-carboxamide |
| Formula: | C9 H11 N5 O2 |
| Formal charge: | 0 |
| Formula weight: | 221.216 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | N-(2-propyl-2H-tetrazol-5-yl)furan-2-carboxamide |
| OpenEye OEToolkits | 2.0.7 | ~{N}-(2-propyl-1,2,3,4-tetrazol-5-yl)furan-2-carboxamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | n2nc(NC(=O)c1ccco1)nn2CCC |
| InChI | InChI | 1.03 | InChI=1S/C9H11N5O2/c1-2-5-14-12-9(11-13-14)10-8(15)7-4-3-6-16-7/h3-4,6H,2,5H2,1H3,(H,10,12,15) |
| InChIKey | InChI | 1.03 | DFAKOYAKHWMEQD-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCCn1nnc(NC(=O)c2occc2)n1 |
| SMILES | CACTVS | 3.385 | CCCn1nnc(NC(=O)c2occc2)n1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCCn1nc(nn1)NC(=O)c2ccco2 |
| SMILES | OpenEye OEToolkits | 2.0.7 | CCCn1nc(nn1)NC(=O)c2ccco2 |
