3-[6-[3,5-bis(fluoranyl)phenyl]-2-methoxy-7-oxidanylidene-pteridin-8-yl]propanenitrile

Systemtic Name: 3-[6-[3,5-bis(fluoranyl)phenyl]-2-methoxy-7-oxidanylidene-pteridin-8-yl]propanenitrile Openeye Name: 3-[6-(3,5-difluorophenyl)-2-methoxy-7-oxo-pteridin-8-yl]propanenitrile CAS Name: 3-[6-(3,5-difluorophenyl)-2-methoxy-7-oxo-8-pteridinyl]propanenitrile IUPAC Name: 3-[6-(3,5-difluorophenyl)-2-methoxy-7-oxopteridin-8-yl]propanenitrile Traditional Name: 3-[6-(3,5-difluorophenyl)-7-keto-2-methoxy-pteridin-8-yl]propionitrile Formula: C16H11F2N5O2 MolecularWeight: 343.287646

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=C2C(=N1)N(C(=O)C(=N2)C3=CC(=CC(=C3)F)F)CCC#N

Isomeric SMILES

COC1=NC=C2C(=N1)N(C(=O)C(=N2)C3=CC(=CC(=C3)F)F)CCC#N

InChI

InChI=1S/C16H11F2N5O2/c1-25-16-20-8-12-14(22-16)23(4-2-3-19)15(24)13(21-12)9-5-10(17)7-11(18)6-9/h5-8H,2,4H2,1H3