A1D83
Summary
| Name: | 2-azanyl-3-(2,6-dimethyl-3-oxidanyl-phenyl)-5-pyridin-4-yl-benzamide |
| Formula: | C20 H19 N3 O2 |
| Formal charge: | 0 |
| Formula weight: | 333.384 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 2-azanyl-3-(2,6-dimethyl-3-oxidanyl-phenyl)-5-pyridin-4-yl-benzamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C20H19N3O2/c1-11-3-4-17(24)12(2)18(11)15-9-14(13-5-7-23-8-6-13)10-16(19(15)21)20(22)25/h3-10,24H,21H2,1-2H3,(H2,22,25) |
| InChIKey | InChI | 1.06 | WMCIJTOVEOXHKF-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cc1ccc(O)c(C)c1c2cc(cc(C(N)=O)c2N)c3ccncc3 |
| SMILES | CACTVS | 3.385 | Cc1ccc(O)c(C)c1c2cc(cc(C(N)=O)c2N)c3ccncc3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cc1ccc(c(c1c2cc(cc(c2N)C(=O)N)c3ccncc3)C)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | Cc1ccc(c(c1c2cc(cc(c2N)C(=O)N)c3ccncc3)C)O |
