Y78
Summary
| Name: | 6-methyl-~{N}-[(5-methylfuran-2-yl)methyl]-3-(4-methylphenyl)-1,2,4-triazin-5-amine |
| Formula: | C17 H18 N4 O |
| Formal charge: | 0 |
| Formula weight: | 294.351 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 6-methyl-~{N}-[(5-methylfuran-2-yl)methyl]-3-(4-methylphenyl)-1,2,4-triazin-5-amine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C17H18N4O/c1-11-4-7-14(8-5-11)17-19-16(13(3)20-21-17)18-10-15-9-6-12(2)22-15/h4-9H,10H2,1-3H3,(H,18,19,21) |
| InChIKey | InChI | 1.06 | FSPDKAUYNLMGSQ-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cc1oc(CNc2nc(nnc2C)c3ccc(C)cc3)cc1 |
| SMILES | CACTVS | 3.385 | Cc1oc(CNc2nc(nnc2C)c3ccc(C)cc3)cc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cc1ccc(cc1)c2nc(c(nn2)C)NCc3ccc(o3)C |
| SMILES | OpenEye OEToolkits | 2.0.7 | Cc1ccc(cc1)c2nc(c(nn2)C)NCc3ccc(o3)C |
