6-[(1E,4E)-5-ethoxy-5-oxidanyl-3-oxidanylidene-penta-1,4-dienyl]-2-methylsulfanyl-1H-pteridin-4-one

Systemtic Name: 6-[(1E,4E)-5-ethoxy-5-oxidanyl-3-oxidanylidene-penta-1,4-dienyl]-2-methylsulfanyl-1H-pteridin-4-one Openeye Name: 6-[(1E,4E)-5-ethoxy-5-hydroxy-3-oxo-penta-1,4-dienyl]-2-methylsulfanyl-1H-pteridin-4-one CAS Name: 6-[(1E,4E)-5-ethoxy-5-hydroxy-3-oxopenta-1,4-dienyl]-2-(methylthio)-1H-pteridin-4-one IUPAC Name: 6-[(1E,4E)-5-ethoxy-5-hydroxy-3-oxopenta-1,4-dienyl]-2-methylsulfanyl-1H-pteridin-4-one Traditional Name: 6-[(1E,4E)-5-ethoxy-5-hydroxy-3-keto-penta-1,4-dienyl]-2-(methylthio)-1H-pteridin-4-one Formula: C14H14N4O4S MolecularWeight: 334.35036

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=CC(=O)C=CC1=CN=C2C(=N1)C(=O)N=C(N2)SC)O

Isomeric SMILES

CCO/C(=C/C(=O)/C=C/C1=CN=C2C(=N1)C(=O)N=C(N2)SC)/O

InChI

InChI=1S/C14H14N4O4S/c1-3-22-10(20)6-9(19)5-4-8-7-15-12-11(16-8)13(21)18-14(17-12)23-2/h4-7,20H,3H2,1-2H3,(H,15,17,18,21)/b5-4+,10-6+