N-[1-[[5-(6-aminopurin-9-yl)-2-(hydroxymethyl)-4-oxidanyl-oxolan-3-yl]amino]-1-oxidanylidene-propan-2-yl]-2-azanyl-3-phenyl-propanamide

Systemtic Name: N-[1-[[5-(6-aminopurin-9-yl)-2-(hydroxymethyl)-4-oxidanyl-oxolan-3-yl]amino]-1-oxidanylidene-propan-2-yl]-2-azanyl-3-phenyl-propanamide Openeye Name: 2-amino-N-[2-[[5-(6-aminopurin-9-yl)-4-hydroxy-2-(hydroxymethyl)tetrahydrofuran-3-yl]amino]-1-methyl-2-oxo-ethyl]-3-phenyl-propanamide CAS Name: 2-amino-N-[1-[[5-(6-aminopurin-9-yl)-4-hydroxy-2-(hydroxymethyl)-3-oxolanyl]amino]-1-oxopropan-2-yl]-3-phenylpropanamide IUPAC Name: 2-amino-N-[1-[[5-(6-aminopurin-9-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl]amino]-1-oxopropan-2-yl]-3-phenylpropanamide Traditional Name: N-[2-[(5-adenin-9-yl-4-hydroxy-2-methylol-tetrahydrofuran-3-yl)amino]-2-keto-1-methyl-ethyl]-2-amino-3-phenyl-propionamide Formula: C22H28N8O5 MolecularWeight: 484.50832

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1C(OC(C1O)N2C=NC3=C2N=CN=C3N)CO)NC(=O)C(CC4=CC=CC=C4)N

Isomeric SMILES

CC(C(=O)NC1C(OC(C1O)N2C=NC3=C2N=CN=C3N)CO)NC(=O)C(CC4=CC=CC=C4)N

InChI

InChI=1S/C22H28N8O5/c1-11(28-21(34)13(23)7-12-5-3-2-4-6-12)20(33)29-15-14(8-31)35-22(17(15)32)30-10-27-16-18(24)25-9-26-19(16)30/h2-6,9-11,13-15,17,22,31-32H,7-8,23H2,1H3,(H,28,34)(H,29,33)(H2,24,25,26)