97Z
Summary
| Name: | 2-[4-morpholin-4-yl]-3,4-dihydroquinazolin-4-one |
| Formula: | C18 H17 N3 O2 |
| Formal charge: | 0 |
| Formula weight: | 307.346 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | 2-(4-morpholin-4-ylphenyl)-3~{H}-quinazolin-4-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C18H17N3O2/c22-18-15-3-1-2-4-16(15)19-17(20-18)13-5-7-14(8-6-13)21-9-11-23-12-10-21/h1-8H,9-12H2,(H,19,20,22) |
| InChIKey | InChI | 1.03 | PMAAMDFJMLGNBG-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | O=C1NC(=Nc2ccccc12)c3ccc(cc3)N4CCOCC4 |
| SMILES | CACTVS | 3.385 | O=C1NC(=Nc2ccccc12)c3ccc(cc3)N4CCOCC4 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1ccc2c(c1)C(=O)NC(=N2)c3ccc(cc3)N4CCOCC4 |
| SMILES | OpenEye OEToolkits | 2.0.6 | c1ccc2c(c1)C(=O)NC(=N2)c3ccc(cc3)N4CCOCC4 |
