3-[2-(dimethylamino)-7-oxidanylidene-6-phenyl-pteridin-8-yl]propanenitrile

Systemtic Name: 3-[2-(dimethylamino)-7-oxidanylidene-6-phenyl-pteridin-8-yl]propanenitrile Openeye Name: 3-[2-(dimethylamino)-7-oxo-6-phenyl-pteridin-8-yl]propanenitrile CAS Name: 3-[2-(dimethylamino)-7-oxo-6-phenyl-8-pteridinyl]propanenitrile IUPAC Name: 3-[2-(dimethylamino)-7-oxo-6-phenylpteridin-8-yl]propanenitrile Traditional Name: 3-[2-(dimethylamino)-7-keto-6-phenyl-pteridin-8-yl]propionitrile Formula: C17H16N6O MolecularWeight: 320.34854

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC=C2C(=N1)N(C(=O)C(=N2)C3=CC=CC=C3)CCC#N

Isomeric SMILES

CN(C)C1=NC=C2C(=N1)N(C(=O)C(=N2)C3=CC=CC=C3)CCC#N

InChI

InChI=1S/C17H16N6O/c1-22(2)17-19-11-13-15(21-17)23(10-6-9-18)16(24)14(20-13)12-7-4-3-5-8-12/h3-5,7-8,11H,6,10H2,1-2H3