methyl 2-methoxy-5-[(2-methylsulfanyl-4-oxidanyl-6-oxidanylidene-1H-pyrimidin-5-yl)methyl]benzoate

Systemtic Name: methyl 2-methoxy-5-[(2-methylsulfanyl-4-oxidanyl-6-oxidanylidene-1H-pyrimidin-5-yl)methyl]benzoate Openeye Name: methyl 5-[(4-hydroxy-2-methylsulfanyl-6-oxo-1H-pyrimidin-5-yl)methyl]-2-methoxy-benzoate CAS Name: 5-[[4-hydroxy-2-(methylthio)-6-oxo-1H-pyrimidin-5-yl]methyl]-2-methoxybenzoic acid methyl ester IUPAC Name: methyl 5-[(4-hydroxy-2-methylsulfanyl-6-oxo-1H-pyrimidin-5-yl)methyl]-2-methoxybenzoate Traditional Name: 5-[[4-hydroxy-6-keto-2-(methylthio)-1H-pyrimidin-5-yl]methyl]-2-methoxy-benzoic acid methyl ester Formula: C15H16N2O5S MolecularWeight: 336.36294

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC2=C(N=C(NC2=O)SC)O)C(=O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CC2=C(N=C(NC2=O)SC)O)C(=O)OC

InChI

InChI=1S/C15H16N2O5S/c1-21-11-5-4-8(6-9(11)14(20)22-2)7-10-12(18)16-15(23-3)17-13(10)19/h4-6H,7H2,1-3H3,(H2,16,17,18,19)