Q8Q
Summary
| Name: | 11-methyl-8,11,14,18,19,22-hexazatetracyclo[13.5.2.12,6.018,21]tricosa-1(21),2(23),3,5,15(22),16,19-heptaen-7-one |
| Formula: | C18 H20 N6 O |
| Formal charge: | 0 |
| Formula weight: | 336.391 Da |
| Component type: | non-polymer |
| Ambiguous Chemistry Warning: | The chemical description of this component is not well described in this definition. Descriptors and chemical names should be used with caution. |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C18H20N6O/c1-23-9-6-19-16-5-8-24-17(22-16)15(12-21-24)13-3-2-4-14(11-13)18(25)20-7-10-23/h2-5,8,11-12H,6-7,9-10H2,1H3,(H,19,22)(H,20,25) |
| InChIKey | InChI | 1.03 | NSFUDDOTXLELNL-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CN1CCNC(=O)c2cccc(c2)c3cnn4C=CC(=Nc34)NCC1 |
| SMILES | CACTVS | 3.385 | CN1CCNC(=O)c2cccc(c2)c3cnn4C=CC(=Nc34)NCC1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CN1CCNc2ccn3c(n2)c(cn3)-c4cccc(c4)C(=O)NCC1 |
| SMILES | OpenEye OEToolkits | 2.0.7 | CN1CCNc2ccn3c(n2)c(cn3)-c4cccc(c4)C(=O)NCC1 |
