2,6-bis(azanyl)-5-[(1E)-1-hydroxyimino-4-phenylmethoxy-butan-2-yl]-1H-pyrimidin-4-one

Systemtic Name: 2,6-bis(azanyl)-5-[(1E)-1-hydroxyimino-4-phenylmethoxy-butan-2-yl]-1H-pyrimidin-4-one Openeye Name: (1E)-4-benzyloxy-2-(2,6-diamino-4-oxo-1H-pyrimidin-5-yl)butanal oxime CAS Name: (1E)-2-(2,6-diamino-4-oxo-1H-pyrimidin-5-yl)-4-phenylmethoxybutanal oxime IUPAC Name: 2,6-diamino-5-[(1E)-1-hydroxyimino-4-phenylmethoxybutan-2-yl]-1H-pyrimidin-4-one Traditional Name: (1E)-4-benzoxy-2-(2,6-diamino-4-keto-1H-pyrimidin-5-yl)butyraldoxime Formula: C15H19N5O3 MolecularWeight: 317.34306

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCCC(C=NO)C2=C(NC(=NC2=O)N)N

Isomeric SMILES

C1=CC=C(C=C1)COCCC(/C=N/O)C2=C(NC(=NC2=O)N)N

InChI

InChI=1S/C15H19N5O3/c16-13-12(14(21)20-15(17)19-13)11(8-18-22)6-7-23-9-10-4-2-1-3-5-10/h1-5,8,11,22H,6-7,9H2,(H5,16,17,19,20,21)/b18-8+