methyl 5-[(4-oxidanylidene-6-phenyl-1H-pyrimidin-2-yl)sulfanylmethyl]furan-2-carboxylate

Systemtic Name: methyl 5-[(4-oxidanylidene-6-phenyl-1H-pyrimidin-2-yl)sulfanylmethyl]furan-2-carboxylate Openeye Name: methyl 5-[(4-oxo-6-phenyl-1H-pyrimidin-2-yl)sulfanylmethyl]furan-2-carboxylate CAS Name: 5-[[(4-oxo-6-phenyl-1H-pyrimidin-2-yl)thio]methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[(4-oxo-6-phenyl-1H-pyrimidin-2-yl)sulfanylmethyl]furan-2-carboxylate Traditional Name: 5-[[(4-keto-6-phenyl-1H-pyrimidin-2-yl)thio]methyl]furan-2-carboxylic acid methyl ester Formula: C17H14N2O4S MolecularWeight: 342.36906

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(O1)CSC2=NC(=O)C=C(N2)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC=C(O1)CSC2=NC(=O)C=C(N2)C3=CC=CC=C3

InChI

InChI=1S/C17H14N2O4S/c1-22-16(21)14-8-7-12(23-14)10-24-17-18-13(9-15(20)19-17)11-5-3-2-4-6-11/h2-9H,10H2,1H3,(H,18,19,20)