2-[6-(methylamino)purin-9-yl]-1-phenyl-ethanone

Systemtic Name: 2-[6-(methylamino)purin-9-yl]-1-phenyl-ethanone Openeye Name: 2-[6-(methylamino)purin-9-yl]-1-phenyl-ethanone CAS Name: 2-[6-(methylamino)-9-purinyl]-1-phenylethanone IUPAC Name: 2-[6-(methylamino)purin-9-yl]-1-phenylethanone Traditional Name: 2-[6-(methylamino)purin-9-yl]-1-phenyl-ethanone Formula: C14H13N5O MolecularWeight: 267.28592

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC=NC2=C1N=CN2CC(=O)C3=CC=CC=C3

Isomeric SMILES

CNC1=NC=NC2=C1N=CN2CC(=O)C3=CC=CC=C3

InChI

InChI=1S/C14H13N5O/c1-15-13-12-14(17-8-16-13)19(9-18-12)7-11(20)10-5-3-2-4-6-10/h2-6,8-9H,7H2,1H3,(H,15,16,17)