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

Systemtic Name: 4-[[2,4-bis(oxidanylidene)-1H-thieno[3,2-d]pyrimidin-3-yl]methyl]benzoate Openeye Name: 4-[(2,4-dioxo-1H-thieno[3,2-d]pyrimidin-3-yl)methyl]benzoate CAS Name: 4-[(2,4-dioxo-1H-thieno[3,2-d]pyrimidin-3-yl)methyl]benzoate IUPAC Name: 4-[(2,4-dioxo-1H-thieno[3,2-d]pyrimidin-3-yl)methyl]benzoate Traditional Name: 4-[(2,4-diketo-1H-thieno[3,2-d]pyrimidin-3-yl)methyl]benzoate Formula: C14H9N2O4S- MolecularWeight: 301.29726

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN2C(=O)C3=C(C=CS3)NC2=O)C(=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CN2C(=O)C3=C(C=CS3)NC2=O)C(=O)[O-]

InChI

InChI=1S/C14H10N2O4S/c17-12-11-10(5-6-21-11)15-14(20)16(12)7-8-1-3-9(4-2-8)13(18)19/h1-6H,7H2,(H,15,20)(H,18,19)/p-1