A1JWK
Summary
| Name: | ~{N}6-methyl-~{N}2-[(1~{R})-1-phenylethyl]pyridine-2,6-dicarboxamide |
| Formula: | C16 H17 N3 O2 |
| Formal charge: | 0 |
| Formula weight: | 283.325 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 3.1.0.0 | ~{N}6-methyl-~{N}2-[(1~{R})-1-phenylethyl]pyridine-2,6-dicarboxamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C16H17N3O2/c1-11(12-7-4-3-5-8-12)18-16(21)14-10-6-9-13(19-14)15(20)17-2/h3-11H,1-2H3,(H,17,20)(H,18,21)/t11-/m1/s1 |
| InChIKey | InChI | 1.06 | NVQHAWWYSJGWKH-LLVKDONJSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CNC(=O)c1cccc(n1)C(=O)N[C@H](C)c2ccccc2 |
| SMILES | CACTVS | 3.385 | CNC(=O)c1cccc(n1)C(=O)N[CH](C)c2ccccc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | C[C@H](c1ccccc1)NC(=O)c2cccc(n2)C(=O)NC |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | CC(c1ccccc1)NC(=O)c2cccc(n2)C(=O)NC |
