1-ethyl-2-methylsulfanyl-6-oxidanyl-5-[(2S)-pentan-2-yl]pyrimidin-4-one

Systemtic Name: 1-ethyl-2-methylsulfanyl-6-oxidanyl-5-[(2S)-pentan-2-yl]pyrimidin-4-one Openeye Name: 1-ethyl-6-hydroxy-5-[(1S)-1-methylbutyl]-2-methylsulfanyl-pyrimidin-4-one CAS Name: 1-ethyl-6-hydroxy-2-(methylthio)-5-[(2S)-pentan-2-yl]-4-pyrimidinone IUPAC Name: 1-ethyl-6-hydroxy-2-methylsulfanyl-5-[(2S)-pentan-2-yl]pyrimidin-4-one Traditional Name: 1-ethyl-6-hydroxy-5-[(1S)-1-methylbutyl]-2-(methylthio)pyrimidin-4-one Formula: C12H20N2O2S MolecularWeight: 256.3644

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)C1=C(N(C(=NC1=O)SC)CC)O

Isomeric SMILES

CCC[C@H](C)C1=C(N(C(=NC1=O)SC)CC)O

InChI

InChI=1S/C12H20N2O2S/c1-5-7-8(3)9-10(15)13-12(17-4)14(6-2)11(9)16/h8,16H,5-7H2,1-4H3/t8-/m0/s1