YDU
概要
表記: | 2-cyclopentyl-N-(3-methyl-1,2,4-oxadiazol-5-yl)acetamide |
組成式: | C10 H15 N3 O2 |
電荷: | 0 |
化学式量: | 209.245 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 | 2-cyclopentyl-N-(3-methyl-1,2,4-oxadiazol-5-yl)acetamide |
OpenEye OEToolkits | 2.0.7 | 2-cyclopentyl-~{N}-(3-methyl-1,2,4-oxadiazol-5-yl)ethanamide |
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 | O=C(Nc1nc(C)no1)CC1CCCC1 |
InChI | InChI | 1.06 | InChI=1S/C10H15N3O2/c1-7-11-10(15-13-7)12-9(14)6-8-4-2-3-5-8/h8H,2-6H2,1H3,(H,11,12,13,14) |
InChIKey | InChI | 1.06 | BXPGKHXJBBUYFC-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | Cc1noc(NC(=O)CC2CCCC2)n1 |
SMILES | CACTVS | 3.385 | Cc1noc(NC(=O)CC2CCCC2)n1 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cc1nc(on1)NC(=O)CC2CCCC2 |
SMILES | OpenEye OEToolkits | 2.0.7 | Cc1nc(on1)NC(=O)CC2CCCC2 |