5-(2-butylsulfanylethyl)-2-[(2,4-dimethylphenyl)methyl]-4-oxidanyl-1H-pyrimidin-6-one

Systemtic Name: 5-(2-butylsulfanylethyl)-2-[(2,4-dimethylphenyl)methyl]-4-oxidanyl-1H-pyrimidin-6-one Openeye Name: 5-(2-butylsulfanylethyl)-2-[(2,4-dimethylphenyl)methyl]-4-hydroxy-1H-pyrimidin-6-one CAS Name: 5-[2-(butylthio)ethyl]-2-[(2,4-dimethylphenyl)methyl]-4-hydroxy-1H-pyrimidin-6-one IUPAC Name: 5-(2-butylsulfanylethyl)-2-[(2,4-dimethylphenyl)methyl]-4-hydroxy-1H-pyrimidin-6-one Traditional Name: 5-[2-(butylthio)ethyl]-2-(2,4-dimethylbenzyl)-4-hydroxy-1H-pyrimidin-6-one Formula: C19H26N2O2S MolecularWeight: 346.48694

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSCCC1=C(N=C(NC1=O)CC2=C(C=C(C=C2)C)C)O

Isomeric SMILES

CCCCSCCC1=C(N=C(NC1=O)CC2=C(C=C(C=C2)C)C)O

InChI

InChI=1S/C19H26N2O2S/c1-4-5-9-24-10-8-16-18(22)20-17(21-19(16)23)12-15-7-6-13(2)11-14(15)3/h6-7,11H,4-5,8-10,12H2,1-3H3,(H2,20,21,22,23)