1-adamantyl-[3-azanyl-6-ethyl-5-methyl-4-(trifluoromethyl)thieno[2,3-b]pyridin-2-yl]methanone

Systemtic Name: 1-adamantyl-[3-azanyl-6-ethyl-5-methyl-4-(trifluoromethyl)thieno[2,3-b]pyridin-2-yl]methanone Openeye Name: 1-adamantyl-[3-amino-6-ethyl-5-methyl-4-(trifluoromethyl)thieno[2,3-b]pyridin-2-yl]methanone CAS Name: 1-adamantyl-[3-amino-6-ethyl-5-methyl-4-(trifluoromethyl)-2-thieno[2,3-b]pyridinyl]methanone IUPAC Name: 1-adamantyl-[3-amino-6-ethyl-5-methyl-4-(trifluoromethyl)thieno[2,3-b]pyridin-2-yl]methanone Traditional Name: 1-adamantyl-[3-amino-6-ethyl-5-methyl-4-(trifluoromethyl)thieno[2,3-b]pyridin-2-yl]methanone Formula: C22H25F3N2OS MolecularWeight: 422.50691

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C2C(=C(SC2=N1)C(=O)C34CC5CC(C3)CC(C5)C4)N)C(F)(F)F)C

Isomeric SMILES

CCC1=C(C(=C2C(=C(SC2=N1)C(=O)C34CC5CC(C3)CC(C5)C4)N)C(F)(F)F)C

InChI

InChI=1S/C22H25F3N2OS/c1-3-14-10(2)16(22(23,24)25)15-17(26)18(29-20(15)27-14)19(28)21-7-11-4-12(8-21)6-13(5-11)9-21/h11-13H,3-9,26H2,1-2H3