JHW
Summary
| Name: | 8-cyclopropyl-2-pyridin-3-yl-[1,3]thiazolo[5,4-f]quinazolin-9-one |
| Formula: | C17 H12 N4 O S |
| Formal charge: | 0 |
| Formula weight: | 320.368 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 8-cyclopropyl-2-pyridin-3-yl-[1,3]thiazolo[5,4-f]quinazolin-9-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C17H12N4OS/c22-17-14-12(19-9-21(17)11-3-4-11)5-6-13-15(14)23-16(20-13)10-2-1-7-18-8-10/h1-2,5-9,11H,3-4H2 |
| InChIKey | InChI | 1.03 | UZKITQOBTXEXSY-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | O=C1N(C=Nc2ccc3nc(sc3c12)c4cccnc4)C5CC5 |
| SMILES | CACTVS | 3.385 | O=C1N(C=Nc2ccc3nc(sc3c12)c4cccnc4)C5CC5 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc(cnc1)c2nc3ccc4c(c3s2)C(=O)N(C=N4)C5CC5 |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(cnc1)c2nc3ccc4c(c3s2)C(=O)N(C=N4)C5CC5 |
