2-(fluoranylmethyl)-5-(3-methylsulfanylpropyl)-3H-pyrano[2,3-d]pyrimidine-4,7-dione

Systemtic Name: 2-(fluoranylmethyl)-5-(3-methylsulfanylpropyl)-3H-pyrano[2,3-d]pyrimidine-4,7-dione Openeye Name: 2-(fluoromethyl)-5-(3-methylsulfanylpropyl)-3H-pyrano[2,3-d]pyrimidine-4,7-dione CAS Name: 2-(fluoromethyl)-5-[3-(methylthio)propyl]-3H-pyrano[2,3-d]pyrimidine-4,7-dione IUPAC Name: 2-(fluoromethyl)-5-(3-methylsulfanylpropyl)-3H-pyrano[2,3-d]pyrimidine-4,7-dione Traditional Name: 2-(fluoromethyl)-5-[3-(methylthio)propyl]-3H-pyrano[2,3-d]pyrimidine-4,7-quinone Formula: C12H13FN2O3S MolecularWeight: 284.306623

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Descriptors Computed from Structure

Canonical SMILES:

CSCCCC1=CC(=O)OC2=C1C(=O)NC(=N2)CF

Isomeric SMILES

CSCCCC1=CC(=O)OC2=C1C(=O)NC(=N2)CF

InChI

InChI=1S/C12H13FN2O3S/c1-19-4-2-3-7-5-9(16)18-12-10(7)11(17)14-8(6-13)15-12/h5H,2-4,6H2,1H3,(H,14,15,17)