A1L7P
Summary
| Name: | 6-(1,3-dihydroisoindol-2-yl)-3-(5-methylpyridin-3-yl)-1-[[3,4,5-tris(fluoranyl)phenyl]methyl]-1,3,5-triazine-2,4-dione |
| Formula: | C24 H18 F3 N5 O2 |
| Formal charge: | 0 |
| Formula weight: | 465.427 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 6-(1,3-dihydroisoindol-2-yl)-3-(5-methylpyridin-3-yl)-1-[[3,4,5-tris(fluoranyl)phenyl]methyl]-1,3,5-triazine-2,4-dione |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C24H18F3N5O2/c1-14-6-18(10-28-9-14)32-23(33)29-22(30-12-16-4-2-3-5-17(16)13-30)31(24(32)34)11-15-7-19(25)21(27)20(26)8-15/h2-10H,11-13H2,1H3 |
| InChIKey | InChI | 1.06 | OSHILUBZOLSXOR-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cc1cncc(c1)N2C(=O)N=C(N3Cc4ccccc4C3)N(Cc5cc(F)c(F)c(F)c5)C2=O |
| SMILES | CACTVS | 3.385 | Cc1cncc(c1)N2C(=O)N=C(N3Cc4ccccc4C3)N(Cc5cc(F)c(F)c(F)c5)C2=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cc1cc(cnc1)N2C(=O)N=C(N(C2=O)Cc3cc(c(c(c3)F)F)F)N4Cc5ccccc5C4 |
| SMILES | OpenEye OEToolkits | 2.0.7 | Cc1cc(cnc1)N2C(=O)N=C(N(C2=O)Cc3cc(c(c(c3)F)F)F)N4Cc5ccccc5C4 |
