(4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl)methyl 5-bromanyl-2-oxidanyl-benzoate

Systemtic Name: (4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl)methyl 5-bromanyl-2-oxidanyl-benzoate Openeye Name: (4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl 5-bromo-2-hydroxy-benzoate CAS Name: 5-bromo-2-hydroxybenzoic 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 5-bromo-2-hydroxybenzoate Traditional Name: 5-bromo-2-hydroxy-benzoic acid (4-keto-1H-thieno[3,2-d]pyrimidin-2-yl)methyl ester Formula: C14H9BrN2O4S MolecularWeight: 381.20126

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Br)C(=O)OCC2=NC(=O)C3=C(N2)C=CS3)O

Isomeric SMILES

C1=CC(=C(C=C1Br)C(=O)OCC2=NC(=O)C3=C(N2)C=CS3)O

InChI

InChI=1S/C14H9BrN2O4S/c15-7-1-2-10(18)8(5-7)14(20)21-6-11-16-9-3-4-22-12(9)13(19)17-11/h1-5,18H,6H2,(H,16,17,19)