K1G
概要
| 表記: | N,1-dimethyl-N-(propan-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine |
| 組成式: | C10 H15 N5 |
| 電荷: | 0 |
| 化学式量: | 205.26 Da |
| 分子種別: | NON-POLYMER |
化合物名
| プログラム | バージョン | 表記 |
| ACDLabs | 12.01 | N,1-dimethyl-N-(propan-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine |
| OpenEye OEToolkits | 2.0.6 | ~{N},1-dimethyl-~{N}-propan-2-yl-pyrazolo[3,4-d]pyrimidin-4-amine |
化合物記述子（線形表記）
| 種別 | プログラム | バージョン | 表記 |
| SMILES | ACDLabs | 12.01 | n1cnc2n(C)ncc2c1N(C)C(C)C |
| InChI | InChI | 1.03 | InChI=1S/C10H15N5/c1-7(2)14(3)9-8-5-13-15(4)10(8)12-6-11-9/h5-7H,1-4H3 |
| InChIKey | InChI | 1.03 | ACQZDWVVKAKBAO-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC(C)N(C)c1ncnc2n(C)ncc12 |
| SMILES | CACTVS | 3.385 | CC(C)N(C)c1ncnc2n(C)ncc12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | CC(C)N(C)c1c2cnn(c2ncn1)C |
| SMILES | OpenEye OEToolkits | 2.0.6 | CC(C)N(C)c1c2cnn(c2ncn1)C |
