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

Systemtic Name: 6-(1-adamantyl)-3-azanyl-N-propan-2-yl-4-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide Openeye Name: 6-(1-adamantyl)-3-amino-N-isopropyl-4-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide CAS Name: 6-(1-adamantyl)-3-amino-N-propan-2-yl-4-(trifluoromethyl)-2-thieno[2,3-b]pyridinecarboxamide IUPAC Name: 6-(1-adamantyl)-3-amino-N-propan-2-yl-4-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide Traditional Name: 6-(1-adamantyl)-3-amino-N-isopropyl-4-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide Formula: C22H26F3N3OS MolecularWeight: 437.52155

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1=C(C2=C(S1)N=C(C=C2C(F)(F)F)C34CC5CC(C3)CC(C5)C4)N

Isomeric SMILES

CC(C)NC(=O)C1=C(C2=C(S1)N=C(C=C2C(F)(F)F)C34CC5CC(C3)CC(C5)C4)N

InChI

InChI=1S/C22H26F3N3OS/c1-10(2)27-19(29)18-17(26)16-14(22(23,24)25)6-15(28-20(16)30-18)21-7-11-3-12(8-21)5-13(4-11)9-21/h6,10-13H,3-5,7-9,26H2,1-2H3,(H,27,29)