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

Systemtic Name: ethyl 2-methoxy-5-[(2-methylsulfanyl-4-oxidanyl-6-oxidanylidene-1H-pyrimidin-5-yl)methyl]benzoate Openeye Name: ethyl 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 ethyl ester IUPAC Name: ethyl 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 ethyl ester Formula: C16H18N2O5S MolecularWeight: 350.38952

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=CC(=C1)CC2=C(N=C(NC2=O)SC)O)OC

Isomeric SMILES

CCOC(=O)C1=C(C=CC(=C1)CC2=C(N=C(NC2=O)SC)O)OC

InChI

InChI=1S/C16H18N2O5S/c1-4-23-15(21)10-7-9(5-6-12(10)22-2)8-11-13(19)17-16(24-3)18-14(11)20/h5-7H,4,8H2,1-3H3,(H2,17,18,19,20)