UOI
3-methyl-N-(pyridin-4-yl)-1,2-oxazole-5-carboxamide
Created: | 2016-03-24 |
Last modified: | 2016-04-06 |
Find Related PDB Entry |
---|
Find related ligands: |
---|
Chemical Details | |
---|---|
Formal Charge | 0 |
Atom Count | 24 |
Chiral Atom Count | 0 |
Bond Count | 25 |
Aromatic Bond Count | 11 |
Chemical Component Summary | |
---|---|
Name | 3-methyl-N-(pyridin-4-yl)-1,2-oxazole-5-carboxamide |
Systematic Name (OpenEye OEToolkits) | 3-methyl-N-pyridin-4-yl-1,2-oxazole-5-carboxamide |
Formula | C10 H9 N3 O2 |
Molecular Weight | 203.197 |
Type | NON-POLYMER |
Chemical Descriptors | |||
---|---|---|---|
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | Cc2cc(C(Nc1ccncc1)=O)on2 |
SMILES | CACTVS | 3.385 | Cc1cc(on1)C(=O)Nc2ccncc2 |
SMILES | OpenEye OEToolkits | 1.7.6 | Cc1cc(on1)C(=O)Nc2ccncc2 |
Canonical SMILES | CACTVS | 3.385 | Cc1cc(on1)C(=O)Nc2ccncc2 |
Canonical SMILES | OpenEye OEToolkits | 1.7.6 | Cc1cc(on1)C(=O)Nc2ccncc2 |
InChI | InChI | 1.03 | InChI=1S/C10H9N3O2/c1-7-6-9(15-13-7)10(14)12-8-2-4-11-5-3-8/h2-6H,1H3,(H,11,12,14) |
InChIKey | InChI | 1.03 | HPNYMQLDUOKPSU-UHFFFAOYSA-N |
Related Resource References
Resource Name | Reference |
---|---|
PubChem | 35763444 |