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

Systemtic Name: (4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl)methyl 3-(4-methoxyphenyl)propanoate Openeye Name: (4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl 3-(4-methoxyphenyl)propanoate CAS Name: 3-(4-methoxyphenyl)propanoic 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 3-(4-methoxyphenyl)propanoate Traditional Name: 3-(4-methoxyphenyl)propionic acid (4-keto-1H-thieno[3,2-d]pyrimidin-2-yl)methyl ester Formula: C17H16N2O4S MolecularWeight: 344.38494

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCC(=O)OCC2=NC(=O)C3=C(N2)C=CS3

Isomeric SMILES

COC1=CC=C(C=C1)CCC(=O)OCC2=NC(=O)C3=C(N2)C=CS3

InChI

InChI=1S/C17H16N2O4S/c1-22-12-5-2-11(3-6-12)4-7-15(20)23-10-14-18-13-8-9-24-16(13)17(21)19-14/h2-3,5-6,8-9H,4,7,10H2,1H3,(H,18,19,21)