EM6
Summary
| Name: | 6-ethyl-5-methyl-7-oxidanylidene-1H-pyrazolo[1,5-a]pyrimidine-3-carbonitrile |
| Formula: | C10 H10 N4 O |
| Formal charge: | 0 |
| Formula weight: | 202.213 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 1.7.6 | 6-ethyl-5-methyl-7-oxidanylidene-1H-pyrazolo[1,5-a]pyrimidine-3-carbonitrile |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C10H10N4O/c1-3-8-6(2)13-9-7(4-11)5-12-14(9)10(8)15/h5,12H,3H2,1-2H3 |
| InChIKey | InChI | 1.03 | PJIRQIUNBLUWJK-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCC1=C(C)N=C2N(NC=C2C#N)C1=O |
| SMILES | CACTVS | 3.385 | CCC1=C(C)N=C2N(NC=C2C#N)C1=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | CCC1=C(N=C2C(=CNN2C1=O)C#N)C |
| SMILES | OpenEye OEToolkits | 1.7.6 | CCC1=C(N=C2C(=CNN2C1=O)C#N)C |
