4-azanyl-1-[(1S,4R,5S)-4-(hydroxymethyl)-5-oxidanyl-cyclohex-2-en-1-yl]-5-methyl-pyrimidin-2-one

Systemtic Name: 4-azanyl-1-[(1S,4R,5S)-4-(hydroxymethyl)-5-oxidanyl-cyclohex-2-en-1-yl]-5-methyl-pyrimidin-2-one Openeye Name: 4-amino-1-[(1S,4R,5S)-5-hydroxy-4-(hydroxymethyl)cyclohex-2-en-1-yl]-5-methyl-pyrimidin-2-one CAS Name: 4-amino-1-[(1S,4R,5S)-5-hydroxy-4-(hydroxymethyl)-1-cyclohex-2-enyl]-5-methyl-2-pyrimidinone IUPAC Name: 4-amino-1-[(1S,4R,5S)-5-hydroxy-4-(hydroxymethyl)cyclohex-2-en-1-yl]-5-methylpyrimidin-2-one Traditional Name: 4-amino-1-[(1S,4R,5S)-5-hydroxy-4-methylol-cyclohex-2-en-1-yl]-5-methyl-pyrimidin-2-one Formula: C12H17N3O3 MolecularWeight: 251.28168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C(=O)N=C1N)C2CC(C(C=C2)CO)O

Isomeric SMILES

CC1=CN(C(=O)N=C1N)[C@H]2C[C@@H]([C@H](C=C2)CO)O

InChI

InChI=1S/C12H17N3O3/c1-7-5-15(12(18)14-11(7)13)9-3-2-8(6-16)10(17)4-9/h2-3,5,8-10,16-17H,4,6H2,1H3,(H2,13,14,18)/t8-,9-,10+/m1/s1