2-(3-bromanyl-1-adamantyl)-N-methyl-N-[(4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]ethanamide

Systemtic Name: 2-(3-bromanyl-1-adamantyl)-N-methyl-N-[(4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]ethanamide Openeye Name: 2-(3-bromo-1-adamantyl)-N-methyl-N-[(4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]acetamide CAS Name: 2-(3-bromo-1-adamantyl)-N-methyl-N-[(4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]acetamide IUPAC Name: 2-(3-bromo-1-adamantyl)-N-methyl-N-[(4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]acetamide Traditional Name: 2-(3-bromo-1-adamantyl)-N-[(4-keto-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]-N-methyl-acetamide Formula: C20H24BrN3O2S MolecularWeight: 450.39246

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=NC(=O)C2=C(N1)C=CS2)C(=O)CC34CC5CC(C3)CC(C5)(C4)Br

Isomeric SMILES

CN(CC1=NC(=O)C2=C(N1)C=CS2)C(=O)CC34CC5CC(C3)CC(C5)(C4)Br

InChI

InChI=1S/C20H24BrN3O2S/c1-24(10-15-22-14-2-3-27-17(14)18(26)23-15)16(25)9-19-5-12-4-13(6-19)8-20(21,7-12)11-19/h2-3,12-13H,4-11H2,1H3,(H,22,23,26)