(4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl)methyl 2-(1-adamantylcarbonylamino)ethanoate

Systemtic Name: (4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl)methyl 2-(1-adamantylcarbonylamino)ethanoate Openeye Name: (4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl 2-(adamantane-1-carbonylamino)acetate CAS Name: 2-[[1-adamantyl(oxo)methyl]amino]acetic acid (4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl ester IUPAC Name: (4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl 2-(adamantane-1-carbonylamino)acetate Traditional Name: 2-(adamantane-1-carbonylamino)acetic acid (4-keto-1H-thieno[3,2-d]pyrimidin-2-yl)methyl ester Formula: C20H23N3O4S MolecularWeight: 401.47932

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NCC(=O)OCC4=NC(=O)C5=C(N4)C=CS5

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NCC(=O)OCC4=NC(=O)C5=C(N4)C=CS5

InChI

InChI=1S/C20H23N3O4S/c24-16(27-10-15-22-14-1-2-28-17(14)18(25)23-15)9-21-19(26)20-6-11-3-12(7-20)5-13(4-11)8-20/h1-2,11-13H,3-10H2,(H,21,26)(H,22,23,25)