3-[6-[3,5-bis(fluoranyl)phenyl]-2-morpholin-4-yl-7-oxidanylidene-pteridin-8-yl]propanenitrile

Systemtic Name: 3-[6-[3,5-bis(fluoranyl)phenyl]-2-morpholin-4-yl-7-oxidanylidene-pteridin-8-yl]propanenitrile Openeye Name: 3-[6-(3,5-difluorophenyl)-2-morpholino-7-oxo-pteridin-8-yl]propanenitrile CAS Name: 3-[6-(3,5-difluorophenyl)-2-(4-morpholinyl)-7-oxo-8-pteridinyl]propanenitrile IUPAC Name: 3-[6-(3,5-difluorophenyl)-2-morpholin-4-yl-7-oxopteridin-8-yl]propanenitrile Traditional Name: 3-[6-(3,5-difluorophenyl)-7-keto-2-morpholino-pteridin-8-yl]propionitrile Formula: C19H16F2N6O2 MolecularWeight: 398.366146

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC=C3C(=N2)N(C(=O)C(=N3)C4=CC(=CC(=C4)F)F)CCC#N

Isomeric SMILES

C1COCCN1C2=NC=C3C(=N2)N(C(=O)C(=N3)C4=CC(=CC(=C4)F)F)CCC#N

InChI

InChI=1S/C19H16F2N6O2/c20-13-8-12(9-14(21)10-13)16-18(28)27(3-1-2-22)17-15(24-16)11-23-19(25-17)26-4-6-29-7-5-26/h8-11H,1,3-7H2