N-[(5,6-dimethyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-2-yl)methyl]-N-phenethyl-adamantane-1-carboxamide

Systemtic Name: N-[(5,6-dimethyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-2-yl)methyl]-N-phenethyl-adamantane-1-carboxamide Openeye Name: N-[(5,6-dimethyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)methyl]-N-phenethyl-adamantane-1-carboxamide CAS Name: N-[(5,6-dimethyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)methyl]-N-phenethyl-1-adamantanecarboxamide IUPAC Name: N-[(5,6-dimethyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)methyl]-N-phenethyladamantane-1-carboxamide Traditional Name: N-[(4-keto-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl]-N-phenethyl-adamantane-1-carboxamide Formula: C28H33N3O2S MolecularWeight: 475.64552

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)CN(CCC3=CC=CC=C3)C(=O)C45CC6CC(C4)CC(C6)C5)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)CN(CCC3=CC=CC=C3)C(=O)C45CC6CC(C4)CC(C6)C5)C

InChI

InChI=1S/C28H33N3O2S/c1-17-18(2)34-26-24(17)25(32)29-23(30-26)16-31(9-8-19-6-4-3-5-7-19)27(33)28-13-20-10-21(14-28)12-22(11-20)15-28/h3-7,20-22H,8-16H2,1-2H3,(H,29,30,32)