KSR
Summary
| Name: | 6-(5-methoxy-1-methyl-1H-indol-3-yl)-5H-pyrrolo[2,3-b]pyrazine |
| Formula: | C16 H14 N4 O |
| Formal charge: | 0 |
| Formula weight: | 278.309 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 1.6.1 | 6-(5-methoxy-1-methyl-indol-3-yl)-5H-pyrrolo[2,3-b]pyrazine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES_CANONICAL | CACTVS | 3.352 | COc1ccc2n(C)cc(c3[nH]c4nccnc4c3)c2c1 |
| SMILES | CACTVS | 3.352 | COc1ccc2n(C)cc(c3[nH]c4nccnc4c3)c2c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | Cn1cc(c2c1ccc(c2)OC)c3cc4c([nH]3)nccn4 |
| SMILES | OpenEye OEToolkits | 1.7.0 | Cn1cc(c2c1ccc(c2)OC)c3cc4c([nH]3)nccn4 |
| InChI | InChI | 1.03 | InChI=1S/C16H14N4O/c1-20-9-12(11-7-10(21-2)3-4-15(11)20)13-8-14-16(19-13)18-6-5-17-14/h3-9H,1-2H3,(H,18,19) |
| InChIKey | InChI | 1.03 | MIJMZVTYIXYSDK-UHFFFAOYSA-N |
