N-(2-hydroxyethyl)-2-(9-methyl-8-oxidanylidene-2-phenyl-purin-7-yl)-N-phenyl-ethanamide

Systemtic Name: N-(2-hydroxyethyl)-2-(9-methyl-8-oxidanylidene-2-phenyl-purin-7-yl)-N-phenyl-ethanamide Openeye Name: N-(2-hydroxyethyl)-2-(9-methyl-8-oxo-2-phenyl-purin-7-yl)-N-phenyl-acetamide CAS Name: N-(2-hydroxyethyl)-2-(9-methyl-8-oxo-2-phenyl-7-purinyl)-N-phenylacetamide IUPAC Name: N-(2-hydroxyethyl)-2-(9-methyl-8-oxo-2-phenylpurin-7-yl)-N-phenylacetamide Traditional Name: N-(2-hydroxyethyl)-2-(8-keto-9-methyl-2-phenyl-purin-7-yl)-N-phenyl-acetamide Formula: C22H21N5O3 MolecularWeight: 403.43384

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=NC(=NC=C2N(C1=O)CC(=O)N(CCO)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CN1C2=NC(=NC=C2N(C1=O)CC(=O)N(CCO)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H21N5O3/c1-25-21-18(14-23-20(24-21)16-8-4-2-5-9-16)27(22(25)30)15-19(29)26(12-13-28)17-10-6-3-7-11-17/h2-11,14,28H,12-13,15H2,1H3