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

Systemtic Name: ethyl 4-[(5,6-dimethyl-4-oxidanylidene-3H-furo[2,3-d]pyrimidin-2-yl)sulfanyl]butanoate Openeye Name: ethyl 4-[(5,6-dimethyl-4-oxo-3H-furo[2,3-d]pyrimidin-2-yl)sulfanyl]butanoate CAS Name: 4-[(5,6-dimethyl-4-oxo-3H-furo[2,3-d]pyrimidin-2-yl)thio]butanoic acid ethyl ester IUPAC Name: ethyl 4-[(5,6-dimethyl-4-oxo-3H-furo[2,3-d]pyrimidin-2-yl)sulfanyl]butanoate Traditional Name: 4-[(4-keto-5,6-dimethyl-3H-furo[2,3-d]pyrimidin-2-yl)thio]butyric acid ethyl ester Formula: C14H18N2O4S MolecularWeight: 310.36872

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCSC1=NC2=C(C(=C(O2)C)C)C(=O)N1

Isomeric SMILES

CCOC(=O)CCCSC1=NC2=C(C(=C(O2)C)C)C(=O)N1

InChI

InChI=1S/C14H18N2O4S/c1-4-19-10(17)6-5-7-21-14-15-12(18)11-8(2)9(3)20-13(11)16-14/h4-7H2,1-3H3,(H,15,16,18)