4-azanyl-1-[(1R,3S)-3-(2-hydroxyethyl)-2,3-dihydro-1H-pentalen-1-yl]pyrimidin-2-one

Systemtic Name: 4-azanyl-1-[(1R,3S)-3-(2-hydroxyethyl)-2,3-dihydro-1H-pentalen-1-yl]pyrimidin-2-one Openeye Name: 4-amino-1-[(1R,3S)-3-(2-hydroxyethyl)-2,3-dihydro-1H-pentalen-1-yl]pyrimidin-2-one CAS Name: 4-amino-1-[(1R,3S)-3-(2-hydroxyethyl)-2,3-dihydro-1H-pentalen-1-yl]-2-pyrimidinone IUPAC Name: 4-amino-1-[(1R,3S)-3-(2-hydroxyethyl)-2,3-dihydro-1H-pentalen-1-yl]pyrimidin-2-one Traditional Name: 4-amino-1-[(1R,3S)-3-(2-hydroxyethyl)-2,3-dihydro-1H-pentalen-1-yl]pyrimidin-2-one Formula: C14H16N3O2 MolecularWeight: 258.29574

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Descriptors Computed from Structure

Canonical SMILES:

C1C([C]2[CH][CH][CH][C]2C1N3C=CC(=NC3=O)N)CCO

Isomeric SMILES

C1[C@H]([C]2[CH][CH][CH][C]2[C@@H]1N3C=CC(=NC3=O)N)CCO

InChI

InChI=1S/C14H16N3O2/c15-13-4-6-17(14(19)16-13)12-8-9(5-7-18)10-2-1-3-11(10)12/h1-4,6,9,12,18H,5,7-8H2,(H2,15,16,19)/t9-,12-/m1/s1