8UJ
Summary
| Name: | N-{[(3R)-1-cyclopentyl-5-oxopyrrolidin-3-yl]methyl}methanesulfonamide |
| Formula: | C11 H20 N2 O3 S |
| Formal charge: | 0 |
| Formula weight: | 260.353 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | N-{[(3R)-1-cyclopentyl-5-oxopyrrolidin-3-yl]methyl}methanesulfonamide |
| OpenEye OEToolkits | 2.0.6 | ~{N}-[[(3~{R})-1-cyclopentyl-5-oxidanylidene-pyrrolidin-3-yl]methyl]methanesulfonamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | N(CC1CC(=O)N(C1)C2CCCC2)S(C)(=O)=O |
| InChI | InChI | 1.03 | InChI=1S/C11H20N2O3S/c1-17(15,16)12-7-9-6-11(14)13(8-9)10-4-2-3-5-10/h9-10,12H,2-8H2,1H3/t9-/m0/s1 |
| InChIKey | InChI | 1.03 | QNSNIWQIVJPNNJ-VIFPVBQESA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | C[S](=O)(=O)NC[C@H]1CN(C2CCCC2)C(=O)C1 |
| SMILES | CACTVS | 3.385 | C[S](=O)(=O)NC[CH]1CN(C2CCCC2)C(=O)C1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | CS(=O)(=O)NC[C@@H]1CC(=O)N(C1)C2CCCC2 |
| SMILES | OpenEye OEToolkits | 2.0.6 | CS(=O)(=O)NCC1CC(=O)N(C1)C2CCCC2 |
