ZMT
Summary
| Name: | ~{N}-(1-propyl-1,2,3,4-tetrazol-5-yl)thiophene-2-carboxamide |
| Formula: | C9 H11 N5 O S |
| Formal charge: | 0 |
| Formula weight: | 237.282 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | ~{N}-(1-propyl-1,2,3,4-tetrazol-5-yl)thiophene-2-carboxamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C9H11N5OS/c1-2-5-14-9(11-12-13-14)10-8(15)7-4-3-6-16-7/h3-4,6H,2,5H2,1H3,(H,10,11,13,15) |
| InChIKey | InChI | 1.06 | QNTKHVXKWRFNIW-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCCn1nnnc1NC(=O)c2sccc2 |
| SMILES | CACTVS | 3.385 | CCCn1nnnc1NC(=O)c2sccc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCCn1c(nnn1)NC(=O)c2cccs2 |
| SMILES | OpenEye OEToolkits | 2.0.7 | CCCn1c(nnn1)NC(=O)c2cccs2 |
