N-[[3-methyl-2,6-bis(oxidanylidene)-7-(phenylmethyl)purin-8-yl]amino]methanamide

Systemtic Name: N-[[3-methyl-2,6-bis(oxidanylidene)-7-(phenylmethyl)purin-8-yl]amino]methanamide Openeye Name: N-[(7-benzyl-3-methyl-2,6-dioxo-purin-8-yl)amino]formamide CAS Name: N-[[3-methyl-2,6-dioxo-7-(phenylmethyl)-8-purinyl]amino]formamide IUPAC Name: N-[(7-benzyl-3-methyl-2,6-dioxopurin-8-yl)amino]formamide Traditional Name: N-[(7-benzyl-2,6-diketo-3-methyl-purin-8-yl)amino]formamide Formula: C14H14N6O3 MolecularWeight: 314.29936

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)NC1=O)N(C(=N2)NNC=O)CC3=CC=CC=C3

Isomeric SMILES

CN1C2=C(C(=O)NC1=O)N(C(=N2)NNC=O)CC3=CC=CC=C3

InChI

InChI=1S/C14H14N6O3/c1-19-11-10(12(22)17-14(19)23)20(13(16-11)18-15-8-21)7-9-5-3-2-4-6-9/h2-6,8H,7H2,1H3,(H,15,21)(H,16,18)(H,17,22,23)