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

Systemtic Name: (4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl)methyl 4-oxidanylidene-4-phenyl-butanoate Openeye Name: (4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl 4-oxo-4-phenyl-butanoate CAS Name: 4-oxo-4-phenylbutanoic 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 4-oxo-4-phenylbutanoate Traditional Name: 4-keto-4-phenyl-butyric acid (4-keto-1H-thieno[3,2-d]pyrimidin-2-yl)methyl ester Formula: C17H14N2O4S MolecularWeight: 342.36906

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H14N2O4S/c20-13(11-4-2-1-3-5-11)6-7-15(21)23-10-14-18-12-8-9-24-16(12)17(22)19-14/h1-5,8-9H,6-7,10H2,(H,18,19,22)