2-azanyl-6-(2-phenylethynyl)-1H-pteridin-4-one

Systemtic Name: 2-azanyl-6-(2-phenylethynyl)-1H-pteridin-4-one Openeye Name: 2-amino-6-(2-phenylethynyl)-1H-pteridin-4-one CAS Name: 2-amino-6-(2-phenylethynyl)-1H-pteridin-4-one IUPAC Name: 2-amino-6-(2-phenylethynyl)-1H-pteridin-4-one Traditional Name: 2-amino-6-(2-phenylethynyl)-1H-pteridin-4-one Formula: C14H9N5O MolecularWeight: 263.25416

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C#CC2=CN=C3C(=N2)C(=O)N=C(N3)N

Isomeric SMILES

C1=CC=C(C=C1)C#CC2=CN=C3C(=N2)C(=O)N=C(N3)N

InChI

InChI=1S/C14H9N5O/c15-14-18-12-11(13(20)19-14)17-10(8-16-12)7-6-9-4-2-1-3-5-9/h1-5,8H,(H3,15,16,18,19,20)