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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(N=C(NC1=O)SCC(C)C)O

Isomeric SMILES

CCCCC1=C(N=C(NC1=O)SCC(C)C)O

InChI

InChI=1S/C12H20N2O2S/c1-4-5-6-9-10(15)13-12(14-11(9)16)17-7-8(2)3/h8H,4-7H2,1-3H3,(H2,13,14,15,16)