8N3
Summary
| Name: | (2R)-4-methyl-2-[(3-methylphenyl)methylcarbamoylamino]-N-oxidanyl-pentanamide |
| Formula: | C15 H23 N3 O3 |
| Formal charge: | 0 |
| Formula weight: | 293.361 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | (2~{R})-4-methyl-2-[(3-methylphenyl)methylcarbamoylamino]-~{N}-oxidanyl-pentanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C15H23N3O3/c1-10(2)7-13(14(19)18-21)17-15(20)16-9-12-6-4-5-11(3)8-12/h4-6,8,10,13,21H,7,9H2,1-3H3,(H,18,19)(H2,16,17,20)/t13-/m1/s1 |
| InChIKey | InChI | 1.03 | XSZYRFNGBBJUNJ-CYBMUJFWSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC(C)C[C@@H](NC(=O)NCc1cccc(C)c1)C(=O)NO |
| SMILES | CACTVS | 3.385 | CC(C)C[CH](NC(=O)NCc1cccc(C)c1)C(=O)NO |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | Cc1cccc(c1)CNC(=O)N[C@H](CC(C)C)C(=O)NO |
| SMILES | OpenEye OEToolkits | 2.0.6 | Cc1cccc(c1)CNC(=O)NC(CC(C)C)C(=O)NO |
