ethyl 4-([1]benzofuro[3,2-d]pyrimidin-4-ylsulfanyl)-3-oxidanylidene-butanoate

Systemtic Name: ethyl 4-([1]benzofuro[3,2-d]pyrimidin-4-ylsulfanyl)-3-oxidanylidene-butanoate Openeye Name: ethyl 4-(benzofuro[3,2-d]pyrimidin-4-ylsulfanyl)-3-oxo-butanoate CAS Name: 4-(4-benzofuro[3,2-d]pyrimidinylthio)-3-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-([1]benzofuro[3,2-d]pyrimidin-4-ylsulfanyl)-3-oxobutanoate Traditional Name: 4-(benzofuro[3,2-d]pyrimidin-4-ylthio)-3-keto-butyric acid ethyl ester Formula: C16H14N2O4S MolecularWeight: 330.35836

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(=O)CSC1=NC=NC2=C1OC3=CC=CC=C32

Isomeric SMILES

CCOC(=O)CC(=O)CSC1=NC=NC2=C1OC3=CC=CC=C32

InChI

InChI=1S/C16H14N2O4S/c1-2-21-13(20)7-10(19)8-23-16-15-14(17-9-18-16)11-5-3-4-6-12(11)22-15/h3-6,9H,2,7-8H2,1H3