M5W
Summary
| Name: | 5-amino-1-~{tert}-butyl-3-(3-methoxyphenyl)pyrazole-4-carboxamide |
| Formula: | C15 H20 N4 O2 |
| Formal charge: | 0 |
| Formula weight: | 288.345 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 5-azanyl-1-~{tert}-butyl-3-(3-methoxyphenyl)pyrazole-4-carboxamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C15H20N4O2/c1-15(2,3)19-13(16)11(14(17)20)12(18-19)9-6-5-7-10(8-9)21-4/h5-8H,16H2,1-4H3,(H2,17,20) |
| InChIKey | InChI | 1.03 | QDGDUSBCURLURJ-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COc1cccc(c1)c2nn(c(N)c2C(N)=O)C(C)(C)C |
| SMILES | CACTVS | 3.385 | COc1cccc(c1)c2nn(c(N)c2C(N)=O)C(C)(C)C |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CC(C)(C)n1c(c(c(n1)c2cccc(c2)OC)C(=O)N)N |
| SMILES | OpenEye OEToolkits | 2.0.7 | CC(C)(C)n1c(c(c(n1)c2cccc(c2)OC)C(=O)N)N |
