2-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-N-(1-oxidanyl-1-phenyl-propan-2-yl)ethanamide

Systemtic Name: 2-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-N-(1-oxidanyl-1-phenyl-propan-2-yl)ethanamide Openeye Name: 2-(2-amino-6-oxo-3H-purin-9-yl)-N-(2-hydroxy-1-methyl-2-phenyl-ethyl)acetamide CAS Name: 2-(2-amino-6-oxo-3H-purin-9-yl)-N-(1-hydroxy-1-phenylpropan-2-yl)acetamide IUPAC Name: 2-(2-amino-6-oxo-3H-purin-9-yl)-N-(1-hydroxy-1-phenylpropan-2-yl)acetamide Traditional Name: 2-(2-amino-6-keto-3H-purin-9-yl)-N-(2-hydroxy-1-methyl-2-phenyl-ethyl)acetamide Formula: C16H18N6O3 MolecularWeight: 342.35252

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC=CC=C1)O)NC(=O)CN2C=NC3=C2NC(=NC3=O)N

Isomeric SMILES

CC(C(C1=CC=CC=C1)O)NC(=O)CN2C=NC3=C2NC(=NC3=O)N

InChI

InChI=1S/C16H18N6O3/c1-9(13(24)10-5-3-2-4-6-10)19-11(23)7-22-8-18-12-14(22)20-16(17)21-15(12)25/h2-6,8-9,13,24H,7H2,1H3,(H,19,23)(H3,17,20,21,25)