6-(1-adamantyl)-3-azanyl-N-cyclopropyl-4-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide

Systemtic Name: 6-(1-adamantyl)-3-azanyl-N-cyclopropyl-4-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide Openeye Name: 6-(1-adamantyl)-3-amino-N-cyclopropyl-4-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide CAS Name: 6-(1-adamantyl)-3-amino-N-cyclopropyl-4-(trifluoromethyl)-2-thieno[2,3-b]pyridinecarboxamide IUPAC Name: 6-(1-adamantyl)-3-amino-N-cyclopropyl-4-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide Traditional Name: 6-(1-adamantyl)-3-amino-N-cyclopropyl-4-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide Formula: C22H24F3N3OS MolecularWeight: 435.50567

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C2=C(C3=C(S2)N=C(C=C3C(F)(F)F)C45CC6CC(C4)CC(C6)C5)N

Isomeric SMILES

C1CC1NC(=O)C2=C(C3=C(S2)N=C(C=C3C(F)(F)F)C45CC6CC(C4)CC(C6)C5)N

InChI

InChI=1S/C22H24F3N3OS/c23-22(24,25)14-6-15(21-7-10-3-11(8-21)5-12(4-10)9-21)28-20-16(14)17(26)18(30-20)19(29)27-13-1-2-13/h6,10-13H,1-5,7-9,26H2,(H,27,29)