2-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-N-[[bis(2-hydroxyethyl)amino]methyl]ethanamide

Systemtic Name: 2-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-N-[[bis(2-hydroxyethyl)amino]methyl]ethanamide Openeye Name: 2-(2-amino-6-oxo-3H-purin-9-yl)-N-[[bis(2-hydroxyethyl)amino]methyl]acetamide CAS Name: 2-(2-amino-6-oxo-3H-purin-9-yl)-N-[[bis(2-hydroxyethyl)amino]methyl]acetamide IUPAC Name: 2-(2-amino-6-oxo-3H-purin-9-yl)-N-[[bis(2-hydroxyethyl)amino]methyl]acetamide Traditional Name: 2-(2-amino-6-keto-3H-purin-9-yl)-N-[[bis(2-hydroxyethyl)amino]methyl]acetamide Formula: C12H19N7O4 MolecularWeight: 325.32376

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(N1CC(=O)NCN(CCO)CCO)NC(=NC2=O)N

Isomeric SMILES

C1=NC2=C(N1CC(=O)NCN(CCO)CCO)NC(=NC2=O)N

InChI

InChI=1S/C12H19N7O4/c13-12-16-10-9(11(23)17-12)15-7-19(10)5-8(22)14-6-18(1-3-20)2-4-21/h7,20-21H,1-6H2,(H,14,22)(H3,13,16,17,23)