1-adamantyl-[3-azanyl-4-methyl-6-(trifluoromethyl)thieno[2,3-b]pyridin-2-yl]methanone

Systemtic Name: 1-adamantyl-[3-azanyl-4-methyl-6-(trifluoromethyl)thieno[2,3-b]pyridin-2-yl]methanone Openeye Name: 1-adamantyl-[3-amino-4-methyl-6-(trifluoromethyl)thieno[2,3-b]pyridin-2-yl]methanone CAS Name: 1-adamantyl-[3-amino-4-methyl-6-(trifluoromethyl)-2-thieno[2,3-b]pyridinyl]methanone IUPAC Name: 1-adamantyl-[3-amino-4-methyl-6-(trifluoromethyl)thieno[2,3-b]pyridin-2-yl]methanone Traditional Name: 1-adamantyl-[3-amino-4-methyl-6-(trifluoromethyl)thieno[2,3-b]pyridin-2-yl]methanone Formula: C20H21F3N2OS MolecularWeight: 394.45375

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C(=C(S2)C(=O)C34CC5CC(C3)CC(C5)C4)N)C(F)(F)F

Isomeric SMILES

CC1=CC(=NC2=C1C(=C(S2)C(=O)C34CC5CC(C3)CC(C5)C4)N)C(F)(F)F

InChI

InChI=1S/C20H21F3N2OS/c1-9-2-13(20(21,22)23)25-18-14(9)15(24)16(27-18)17(26)19-6-10-3-11(7-19)5-12(4-10)8-19/h2,10-12H,3-8,24H2,1H3