A1E5J
Summary
| Name: | 9-azanyl-10-(7-fluoranyl-1H-indazol-4-yl)-6-methyl-2,3,4,7-tetrahydropyrano[2,3-f][1,7]naphthyridin-8-one |
| Formula: | C19 H16 F N5 O2 |
| Formal charge: | 0 |
| Formula weight: | 365.361 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 9-azanyl-10-(7-fluoranyl-1~{H}-indazol-4-yl)-6-methyl-2,3,4,7-tetrahydropyrano[2,3-f][1,7]naphthyridin-8-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C19H16FN5O2/c1-8-16-14(18-12(23-8)3-2-6-27-18)13(15(21)19(26)24-16)9-4-5-11(20)17-10(9)7-22-25-17/h4-5,7H,2-3,6,21H2,1H3,(H,22,25)(H,24,26) |
| InChIKey | InChI | 1.06 | ODIVXMYGTZYNQI-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cc1nc2CCCOc2c3c1NC(=O)C(=C3c4ccc(F)c5[nH]ncc45)N |
| SMILES | CACTVS | 3.385 | Cc1nc2CCCOc2c3c1NC(=O)C(=C3c4ccc(F)c5[nH]ncc45)N |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cc1c2c(c3c(n1)CCCO3)C(=C(C(=O)N2)N)c4ccc(c5c4cn[nH]5)F |
| SMILES | OpenEye OEToolkits | 2.0.7 | Cc1c2c(c3c(n1)CCCO3)C(=C(C(=O)N2)N)c4ccc(c5c4cn[nH]5)F |
