2-[(1R)-1-(1-adamantylmethylamino)ethyl]-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[(1R)-1-(1-adamantylmethylamino)ethyl]-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[(1R)-1-(1-adamantylmethylamino)ethyl]-5-(2-thienyl)-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[(1R)-1-(1-adamantylmethylamino)ethyl]-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[(1R)-1-(1-adamantylmethylamino)ethyl]-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[(1R)-1-(1-adamantylmethylamino)ethyl]-5-(2-thienyl)-3H-thieno[2,3-d]pyrimidin-4-one Formula: C23H27N3OS2 MolecularWeight: 425.60998

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=C(C(=CS2)C3=CC=CS3)C(=O)N1)NCC45CC6CC(C4)CC(C6)C5

Isomeric SMILES

C[C@H](C1=NC2=C(C(=CS2)C3=CC=CS3)C(=O)N1)NCC45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C23H27N3OS2/c1-13(24-12-23-8-14-5-15(9-23)7-16(6-14)10-23)20-25-21(27)19-17(11-29-22(19)26-20)18-3-2-4-28-18/h2-4,11,13-16,24H,5-10,12H2,1H3,(H,25,26,27)/t13-,14?,15?,16?,23?/m1/s1