IA7
Summary
| Name: | 5,7-bis(azanyl)-2-tert-butyl-4-(1,3-thiazol-2-yl)pyrido[2,3-d]pyrimidine-6-carbonitrile |
| Formula: | C15 H15 N7 S |
| Formal charge: | 0 |
| Formula weight: | 325.392 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 1.7.6 | 5,7-bis(azanyl)-2-tert-butyl-4-(1,3-thiazol-2-yl)pyrido[2,3-d]pyrimidine-6-carbonitrile |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C15H15N7S/c1-15(2,3)14-20-10(13-19-4-5-23-13)8-9(17)7(6-16)11(18)21-12(8)22-14/h4-5H,1-3H3,(H4,17,18,20,21,22) |
| InChIKey | InChI | 1.03 | VDKRFQKJPXSMOG-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC(C)(C)c1nc2nc(N)c(C#N)c(N)c2c(n1)c3sccn3 |
| SMILES | CACTVS | 3.385 | CC(C)(C)c1nc2nc(N)c(C#N)c(N)c2c(n1)c3sccn3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | CC(C)(C)c1nc(c2c(c(c(nc2n1)N)C#N)N)c3nccs3 |
| SMILES | OpenEye OEToolkits | 1.7.6 | CC(C)(C)c1nc(c2c(c(c(nc2n1)N)C#N)N)c3nccs3 |
