767
概要
| 表記: | N2-(3-(dimethylamino)propyl)-6,7-dimethoxy-N4,N4-dimethylquinazoline-2,4-diamine |
| 組成式: | C17 H27 N5 O2 |
| 電荷: | 0 |
| 化学式量: | 333.429 Da |
| 分子種別: | NON-POLYMER |
化合物名
| プログラム | バージョン | 表記 |
| OpenEye OEToolkits | 2.0.5 | ~{N}2-[3-(dimethylamino)propyl]-6,7-dimethoxy-~{N}4,~{N}4-dimethyl-quinazoline-2,4-diamine |
化合物記述子（線形表記）
| 種別 | プログラム | バージョン | 表記 |
| InChI | InChI | 1.03 | InChI=1S/C17H27N5O2/c1-21(2)9-7-8-18-17-19-13-11-15(24-6)14(23-5)10-12(13)16(20-17)22(3)4/h10-11H,7-9H2,1-6H3,(H,18,19,20) |
| InChIKey | InChI | 1.03 | OGNSGOBRJCYTGK-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COc1cc2nc(NCCCN(C)C)nc(N(C)C)c2cc1OC |
| SMILES | CACTVS | 3.385 | COc1cc2nc(NCCCN(C)C)nc(N(C)C)c2cc1OC |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.5 | CN(C)CCCNc1nc2cc(c(cc2c(n1)N(C)C)OC)OC |
| SMILES | OpenEye OEToolkits | 2.0.5 | CN(C)CCCNc1nc2cc(c(cc2c(n1)N(C)C)OC)OC |
