ethyl 3-[(5,6-dimethyl-4-oxidanylidene-3H-furo[2,3-d]pyrimidin-2-yl)sulfanyl]propanoate

Systemtic Name: ethyl 3-[(5,6-dimethyl-4-oxidanylidene-3H-furo[2,3-d]pyrimidin-2-yl)sulfanyl]propanoate Openeye Name: ethyl 3-[(5,6-dimethyl-4-oxo-3H-furo[2,3-d]pyrimidin-2-yl)sulfanyl]propanoate CAS Name: 3-[(5,6-dimethyl-4-oxo-3H-furo[2,3-d]pyrimidin-2-yl)thio]propanoic acid ethyl ester IUPAC Name: ethyl 3-[(5,6-dimethyl-4-oxo-3H-furo[2,3-d]pyrimidin-2-yl)sulfanyl]propanoate Traditional Name: 3-[(4-keto-5,6-dimethyl-3H-furo[2,3-d]pyrimidin-2-yl)thio]propionic acid ethyl ester Formula: C13H16N2O4S MolecularWeight: 296.34214

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCSC1=NC2=C(C(=C(O2)C)C)C(=O)N1

Isomeric SMILES

CCOC(=O)CCSC1=NC2=C(C(=C(O2)C)C)C(=O)N1

InChI

InChI=1S/C13H16N2O4S/c1-4-18-9(16)5-6-20-13-14-11(17)10-7(2)8(3)19-12(10)15-13/h4-6H2,1-3H3,(H,14,15,17)