T6B
Summary
Name: | [5-(1-methylpyrrolo[2,3-b]pyridin-4-yl)furan-2-yl]-morpholin-4-yl-methanone |
Synonyms: | 1-methyl-4-[5-(morpholin-4-ylcarbonyl)-2-furyl]-1H-pyrrolo[2,3-b]pyridine |
Formula: | C17 H17 N3 O3 |
Formal charge: | 0 |
Formula weight: | 311.335 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.7 | [5-(1-methylpyrrolo[2,3-b]pyridin-4-yl)furan-2-yl]-morpholin-4-yl-methanone |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.06 | InChI=1S/C17H17N3O3/c1-19-7-5-13-12(4-6-18-16(13)19)14-2-3-15(23-14)17(21)20-8-10-22-11-9-20/h2-7H,8-11H2,1H3 |
InChIKey | InChI | 1.06 | GADYVYMUQFVEQZ-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | Cn1ccc2c(ccnc12)c3oc(cc3)C(=O)N4CCOCC4 |
SMILES | CACTVS | 3.385 | Cn1ccc2c(ccnc12)c3oc(cc3)C(=O)N4CCOCC4 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cn1ccc2c1nccc2c3ccc(o3)C(=O)N4CCOCC4 |
SMILES | OpenEye OEToolkits | 2.0.7 | Cn1ccc2c1nccc2c3ccc(o3)C(=O)N4CCOCC4 |