1-[(2R,4S,5R)-5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-4-(phenethylamino)pyrimidin-2-one

Systemtic Name: 1-[(2R,4S,5R)-5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-4-(phenethylamino)pyrimidin-2-one Openeye Name: 1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-4-(phenethylamino)pyrimidin-2-one CAS Name: 1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)-2-oxolanyl]-4-(phenethylamino)-2-pyrimidinone IUPAC Name: 1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-4-(phenethylamino)pyrimidin-2-one Traditional Name: 1-[(2R,4S,5R)-4-hydroxy-5-methylol-tetrahydrofuran-2-yl]-4-(phenethylamino)pyrimidin-2-one Formula: C17H21N3O4 MolecularWeight: 331.36634

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC1N2C=CC(=NC2=O)NCCC3=CC=CC=C3)CO)O

Isomeric SMILES

C1[C@@H]([C@H](O[C@H]1N2C=CC(=NC2=O)NCCC3=CC=CC=C3)CO)O

InChI

InChI=1S/C17H21N3O4/c21-11-14-13(22)10-16(24-14)20-9-7-15(19-17(20)23)18-8-6-12-4-2-1-3-5-12/h1-5,7,9,13-14,16,21-22H,6,8,10-11H2,(H,18,19,23)/t13-,14+,16+/m0/s1