2-[(2-ethyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]ethanoate

Systemtic Name: 2-[(2-ethyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]ethanoate Openeye Name: 2-(2-ethylbenzofuro[3,2-d]pyrimidin-4-yl)sulfanylacetate CAS Name: 2-[(2-ethyl-4-benzofuro[3,2-d]pyrimidinyl)thio]acetate IUPAC Name: 2-[(2-ethyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]acetate Traditional Name: 2-[(2-ethylbenzofuro[3,2-d]pyrimidin-4-yl)thio]acetate Formula: C14H11N2O3S- MolecularWeight: 287.31374

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(C(=N1)SCC(=O)[O-])OC3=CC=CC=C32

Isomeric SMILES

CCC1=NC2=C(C(=N1)SCC(=O)[O-])OC3=CC=CC=C32

InChI

InChI=1S/C14H12N2O3S/c1-2-10-15-12-8-5-3-4-6-9(8)19-13(12)14(16-10)20-7-11(17)18/h3-6H,2,7H2,1H3,(H,17,18)/p-1