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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NC=C2C(=N1)N(C(=O)C(=N2)C3=CC=CC=C3)CCC#N

Isomeric SMILES

CCNC1=NC=C2C(=N1)N(C(=O)C(=N2)C3=CC=CC=C3)CCC#N

InChI

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