G5Z
Summary
| Name: | (2~{R})-2-azanyl-~{N}-(4-ethanoyl-5-pyridin-3-yl-1,3-thiazol-2-yl)propanamide |
| Formula: | C13 H14 N4 O2 S |
| Formal charge: | 0 |
| Formula weight: | 290.341 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | (2~{R})-2-azanyl-~{N}-(4-ethanoyl-5-pyridin-3-yl-1,3-thiazol-2-yl)propanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C13H14N4O2S/c1-7(14)12(19)17-13-16-10(8(2)18)11(20-13)9-4-3-5-15-6-9/h3-7H,14H2,1-2H3,(H,16,17,19)/t7-/m1/s1 |
| InChIKey | InChI | 1.03 | KLVIQLBTZDKJSI-SSDOTTSWSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | C[C@@H](N)C(=O)Nc1sc(c2cccnc2)c(n1)C(C)=O |
| SMILES | CACTVS | 3.385 | C[CH](N)C(=O)Nc1sc(c2cccnc2)c(n1)C(C)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | C[C@H](C(=O)Nc1nc(c(s1)c2cccnc2)C(=O)C)N |
| SMILES | OpenEye OEToolkits | 2.0.6 | CC(C(=O)Nc1nc(c(s1)c2cccnc2)C(=O)C)N |
