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

Systemtic Name: (4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl)methyl 2-(phenoxymethyl)benzoate Openeye Name: (4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl 2-(phenoxymethyl)benzoate CAS Name: 2-(phenoxymethyl)benzoic 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-(phenoxymethyl)benzoate Traditional Name: 2-(phenoxymethyl)benzoic acid (4-keto-1H-thieno[3,2-d]pyrimidin-2-yl)methyl ester Formula: C21H16N2O4S MolecularWeight: 392.42774

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCC2=CC=CC=C2C(=O)OCC3=NC(=O)C4=C(N3)C=CS4

Isomeric SMILES

C1=CC=C(C=C1)OCC2=CC=CC=C2C(=O)OCC3=NC(=O)C4=C(N3)C=CS4

InChI

InChI=1S/C21H16N2O4S/c24-20-19-17(10-11-28-19)22-18(23-20)13-27-21(25)16-9-5-4-6-14(16)12-26-15-7-2-1-3-8-15/h1-11H,12-13H2,(H,22,23,24)