W4L
Summary
| Name: | N~2~-[(6-chloropyridin-3-yl)methyl]-N,N~2~-diethylglycinamide |
| Formula: | C12 H18 Cl N3 O |
| Formal charge: | 0 |
| Formula weight: | 255.744 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | N~2~-[(6-chloropyridin-3-yl)methyl]-N,N~2~-diethylglycinamide |
| OpenEye OEToolkits | 2.0.7 | 2-[(6-chloranylpyridin-3-yl)methyl-ethyl-amino]-~{N}-ethyl-ethanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | Clc1ccc(CN(CC)CC(=O)NCC)cn1 |
| InChI | InChI | 1.06 | InChI=1S/C12H18ClN3O/c1-3-14-12(17)9-16(4-2)8-10-5-6-11(13)15-7-10/h5-7H,3-4,8-9H2,1-2H3,(H,14,17) |
| InChIKey | InChI | 1.06 | CNDPRGRRGUUQLK-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCNC(=O)CN(CC)Cc1ccc(Cl)nc1 |
| SMILES | CACTVS | 3.385 | CCNC(=O)CN(CC)Cc1ccc(Cl)nc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCNC(=O)CN(CC)Cc1ccc(nc1)Cl |
| SMILES | OpenEye OEToolkits | 2.0.7 | CCNC(=O)CN(CC)Cc1ccc(nc1)Cl |
