methyl 9-(4-cyanophenyl)purine-6-carboximidate

Systemtic Name: methyl 9-(4-cyanophenyl)purine-6-carboximidate Openeye Name: methyl 9-(4-cyanophenyl)purine-6-carboximidate CAS Name: 9-(4-cyanophenyl)-6-purinecarboximidic acid methyl ester IUPAC Name: methyl 9-(4-cyanophenyl)purine-6-carboximidate Traditional Name: 9-(4-cyanophenyl)purine-6-carboximidic acid methyl ester Formula: C14H10N6O MolecularWeight: 278.2688

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Descriptors Computed from Structure

Canonical SMILES:

COC(=N)C1=C2C(=NC=N1)N(C=N2)C3=CC=C(C=C3)C#N

Isomeric SMILES

COC(=N)C1=C2C(=NC=N1)N(C=N2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C14H10N6O/c1-21-13(16)11-12-14(18-7-17-11)20(8-19-12)10-4-2-9(6-15)3-5-10/h2-5,7-8,16H,1H3