3,5-bis(azanyl)-N-[bis(azanyl)methylidene]-6-(2-phenylethynyl)pyrazine-2-carboxamide

Systemtic Name: 3,5-bis(azanyl)-N-[bis(azanyl)methylidene]-6-(2-phenylethynyl)pyrazine-2-carboxamide Openeye Name: 3,5-diamino-N-(diaminomethylene)-6-(2-phenylethynyl)pyrazine-2-carboxamide CAS Name: 3,5-diamino-N-(diaminomethylidene)-6-(2-phenylethynyl)-2-pyrazinecarboxamide IUPAC Name: 3,5-diamino-N-(diaminomethylidene)-6-(2-phenylethynyl)pyrazine-2-carboxamide Traditional Name: 3,5-diamino-N-(diaminomethylene)-6-(2-phenylethynyl)pyrazinamide Formula: C14H13N7O MolecularWeight: 295.29932

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C#CC2=C(N=C(C(=N2)C(=O)N=C(N)N)N)N

Isomeric SMILES

C1=CC=C(C=C1)C#CC2=C(N=C(C(=N2)C(=O)N=C(N)N)N)N

InChI

InChI=1S/C14H13N7O/c15-11-9(7-6-8-4-2-1-3-5-8)19-10(12(16)20-11)13(22)21-14(17)18/h1-5H,(H4,15,16,20)(H4,17,18,21,22)