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

Systemtic Name: (4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl)methyl 3-phenylmethoxybenzoate Openeye Name: (4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl 3-benzyloxybenzoate CAS Name: 3-phenylmethoxybenzoic 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-phenylmethoxybenzoate Traditional Name: 3-benzoxybenzoic 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)COC2=CC=CC(=C2)C(=O)OCC3=NC(=O)C4=C(N3)C=CS4

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=CC(=C2)C(=O)OCC3=NC(=O)C4=C(N3)C=CS4

InChI

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