2-[(2,4-dimethylphenyl)methyl]-5-[2-(3-methylbutylsulfanyl)ethyl]-4-oxidanyl-1H-pyrimidin-6-one

Systemtic Name: 2-[(2,4-dimethylphenyl)methyl]-5-[2-(3-methylbutylsulfanyl)ethyl]-4-oxidanyl-1H-pyrimidin-6-one Openeye Name: 2-[(2,4-dimethylphenyl)methyl]-4-hydroxy-5-(2-isopentylsulfanylethyl)-1H-pyrimidin-6-one CAS Name: 2-[(2,4-dimethylphenyl)methyl]-4-hydroxy-5-[2-(3-methylbutylthio)ethyl]-1H-pyrimidin-6-one IUPAC Name: 2-[(2,4-dimethylphenyl)methyl]-4-hydroxy-5-[2-(3-methylbutylsulfanyl)ethyl]-1H-pyrimidin-6-one Traditional Name: 2-(2,4-dimethylbenzyl)-4-hydroxy-5-[2-(isoamylthio)ethyl]-1H-pyrimidin-6-one Formula: C20H28N2O2S MolecularWeight: 360.51352

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)CC2=NC(=C(C(=O)N2)CCSCCC(C)C)O)C

Isomeric SMILES

CC1=CC(=C(C=C1)CC2=NC(=C(C(=O)N2)CCSCCC(C)C)O)C

InChI

InChI=1S/C20H28N2O2S/c1-13(2)7-9-25-10-8-17-19(23)21-18(22-20(17)24)12-16-6-5-14(3)11-15(16)4/h5-6,11,13H,7-10,12H2,1-4H3,(H2,21,22,23,24)