N-[3-(2-azanyl-2-oxidanylidene-ethoxy)phenyl]-2-[methyl(7H-purin-6-yl)amino]ethanamide

Systemtic Name: N-[3-(2-azanyl-2-oxidanylidene-ethoxy)phenyl]-2-[methyl(7H-purin-6-yl)amino]ethanamide Openeye Name: N-[3-(2-amino-2-oxo-ethoxy)phenyl]-2-[methyl(7H-purin-6-yl)amino]acetamide CAS Name: N-[3-(2-amino-2-oxoethoxy)phenyl]-2-[methyl(7H-purin-6-yl)amino]acetamide IUPAC Name: N-[3-(2-amino-2-oxoethoxy)phenyl]-2-[methyl(7H-purin-6-yl)amino]acetamide Traditional Name: N-[3-(2-amino-2-keto-ethoxy)phenyl]-2-[methyl(7H-purin-6-yl)amino]acetamide Formula: C16H17N7O3 MolecularWeight: 355.35128

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1=CC(=CC=C1)OCC(=O)N)C2=NC=NC3=C2NC=N3

Isomeric SMILES

CN(CC(=O)NC1=CC(=CC=C1)OCC(=O)N)C2=NC=NC3=C2NC=N3

InChI

InChI=1S/C16H17N7O3/c1-23(16-14-15(19-8-18-14)20-9-21-16)6-13(25)22-10-3-2-4-11(5-10)26-7-12(17)24/h2-5,8-9H,6-7H2,1H3,(H2,17,24)(H,22,25)(H,18,19,20,21)