N-[azanyl-(9-methyl-2-oxidanylidene-1H-purin-6-yl)methylidene]benzamide

Systemtic Name: N-[azanyl-(9-methyl-2-oxidanylidene-1H-purin-6-yl)methylidene]benzamide Openeye Name: N-[amino-(9-methyl-2-oxo-1H-purin-6-yl)methylene]benzamide CAS Name: N-[amino-(9-methyl-2-oxo-1H-purin-6-yl)methylidene]benzamide IUPAC Name: N-[amino-(9-methyl-2-oxo-1H-purin-6-yl)methylidene]benzamide Traditional Name: N-[amino-(2-keto-9-methyl-1H-purin-6-yl)methylene]benzamide Formula: C14H12N6O2 MolecularWeight: 296.28408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC2=C(NC(=O)N=C21)C(=NC(=O)C3=CC=CC=C3)N

Isomeric SMILES

CN1C=NC2=C(NC(=O)N=C21)C(=NC(=O)C3=CC=CC=C3)N

InChI

InChI=1S/C14H12N6O2/c1-20-7-16-10-9(17-14(22)19-12(10)20)11(15)18-13(21)8-5-3-2-4-6-8/h2-7H,1H3,(H2,15,18,21)(H,17,19,22)