N-(8-bromanyl-6-oxidanylidene-3,7-dihydropurin-2-yl)-2-phenyl-ethanamide

Systemtic Name: N-(8-bromanyl-6-oxidanylidene-3,7-dihydropurin-2-yl)-2-phenyl-ethanamide Openeye Name: N-(8-bromo-6-oxo-3,7-dihydropurin-2-yl)-2-phenyl-acetamide CAS Name: N-(8-bromo-6-oxo-3,7-dihydropurin-2-yl)-2-phenylacetamide IUPAC Name: N-(8-bromo-6-oxo-3,7-dihydropurin-2-yl)-2-phenylacetamide Traditional Name: N-(8-bromo-6-keto-3,7-dihydropurin-2-yl)-2-phenyl-acetamide Formula: C13H10BrN5O2 MolecularWeight: 348.1548

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(=O)NC2=NC(=O)C3=C(N2)N=C(N3)Br

Isomeric SMILES

C1=CC=C(C=C1)CC(=O)NC2=NC(=O)C3=C(N2)N=C(N3)Br

InChI

InChI=1S/C13H10BrN5O2/c14-12-16-9-10(17-12)18-13(19-11(9)21)15-8(20)6-7-4-2-1-3-5-7/h1-5H,6H2,(H3,15,16,17,18,19,20,21)