4-oxidanylidene-2-phenyl-6-(pyridin-3-ylmethylamino)-1H-pyrimidine-5-carbonitrile

Systemtic Name: 4-oxidanylidene-2-phenyl-6-(pyridin-3-ylmethylamino)-1H-pyrimidine-5-carbonitrile Openeye Name: 4-oxo-2-phenyl-6-(3-pyridylmethylamino)-1H-pyrimidine-5-carbonitrile CAS Name: 4-oxo-2-phenyl-6-(3-pyridinylmethylamino)-1H-pyrimidine-5-carbonitrile IUPAC Name: 4-oxo-2-phenyl-6-(pyridin-3-ylmethylamino)-1H-pyrimidine-5-carbonitrile Traditional Name: 4-keto-2-phenyl-6-(3-pyridylmethylamino)-1H-pyrimidine-5-carbonitrile Formula: C17H13N5O MolecularWeight: 303.31802

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=O)C(=C(N2)NCC3=CN=CC=C3)C#N

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=O)C(=C(N2)NCC3=CN=CC=C3)C#N

InChI

InChI=1S/C17H13N5O/c18-9-14-16(20-11-12-5-4-8-19-10-12)21-15(22-17(14)23)13-6-2-1-3-7-13/h1-8,10H,11H2,(H2,20,21,22,23)