5-butan-2-yl-2-(2-methylpropylsulfanyl)-4-oxidanyl-1H-pyrimidin-6-one

Systemtic Name: 5-butan-2-yl-2-(2-methylpropylsulfanyl)-4-oxidanyl-1H-pyrimidin-6-one Openeye Name: 4-hydroxy-2-isobutylsulfanyl-5-sec-butyl-1H-pyrimidin-6-one CAS Name: 5-butan-2-yl-4-hydroxy-2-(2-methylpropylthio)-1H-pyrimidin-6-one IUPAC Name: 5-butan-2-yl-4-hydroxy-2-(2-methylpropylsulfanyl)-1H-pyrimidin-6-one Traditional Name: 4-hydroxy-2-(isobutylthio)-5-sec-butyl-1H-pyrimidin-6-one Formula: C12H20N2O2S MolecularWeight: 256.3644

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=C(N=C(NC1=O)SCC(C)C)O

Isomeric SMILES

CCC(C)C1=C(N=C(NC1=O)SCC(C)C)O

InChI

InChI=1S/C12H20N2O2S/c1-5-8(4)9-10(15)13-12(14-11(9)16)17-6-7(2)3/h7-8H,5-6H2,1-4H3,(H2,13,14,15,16)