8E6
Summary
| Name: | 6-fluoranyl-2-(4,5,6,7-tetrahydrothieno[3,2-c]pyridin-2-yl)-1~{H}-benzimidazole-4-carboxamide |
| Formula: | C15 H13 F N4 O S |
| Formal charge: | 0 |
| Formula weight: | 316.353 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | 6-fluoranyl-2-(4,5,6,7-tetrahydrothieno[3,2-c]pyridin-2-yl)-1~{H}-benzimidazole-4-carboxamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C15H13FN4OS/c16-8-4-9(14(17)21)13-10(5-8)19-15(20-13)12-3-7-6-18-2-1-11(7)22-12/h3-5,18H,1-2,6H2,(H2,17,21)(H,19,20) |
| InChIKey | InChI | 1.03 | RVBDGUXYQPDTTD-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | NC(=O)c1cc(F)cc2[nH]c(nc12)c3sc4CCNCc4c3 |
| SMILES | CACTVS | 3.385 | NC(=O)c1cc(F)cc2[nH]c(nc12)c3sc4CCNCc4c3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1c(cc2c(c1C(=O)N)nc([nH]2)c3cc4c(s3)CCNC4)F |
| SMILES | OpenEye OEToolkits | 2.0.6 | c1c(cc2c(c1C(=O)N)nc([nH]2)c3cc4c(s3)CCNC4)F |
