3-[2-(1-adamantyl)-2-oxidanylidene-ethyl]-6-ethyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-[2-(1-adamantyl)-2-oxidanylidene-ethyl]-6-ethyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-[2-(1-adamantyl)-2-oxo-ethyl]-6-ethyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-[2-(1-adamantyl)-2-oxoethyl]-6-ethyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-[2-(1-adamantyl)-2-oxoethyl]-6-ethylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-[2-(1-adamantyl)-2-keto-ethyl]-6-ethyl-thieno[2,3-d]pyrimidin-4-one Formula: C20H24N2O2S MolecularWeight: 356.48176

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(S1)N=CN(C2=O)CC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCC1=CC2=C(S1)N=CN(C2=O)CC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C20H24N2O2S/c1-2-15-6-16-18(25-15)21-11-22(19(16)24)10-17(23)20-7-12-3-13(8-20)5-14(4-12)9-20/h6,11-14H,2-5,7-10H2,1H3