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

Systemtic Name: 2-[(2,4-dimethylphenyl)methyl]-5-(2-ethylsulfanylethyl)-4-oxidanyl-1H-pyrimidin-6-one Openeye Name: 2-[(2,4-dimethylphenyl)methyl]-5-(2-ethylsulfanylethyl)-4-hydroxy-1H-pyrimidin-6-one CAS Name: 2-[(2,4-dimethylphenyl)methyl]-5-[2-(ethylthio)ethyl]-4-hydroxy-1H-pyrimidin-6-one IUPAC Name: 2-[(2,4-dimethylphenyl)methyl]-5-(2-ethylsulfanylethyl)-4-hydroxy-1H-pyrimidin-6-one Traditional Name: 2-(2,4-dimethylbenzyl)-5-[2-(ethylthio)ethyl]-4-hydroxy-1H-pyrimidin-6-one Formula: C17H22N2O2S MolecularWeight: 318.43378

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Descriptors Computed from Structure

Canonical SMILES:

CCSCCC1=C(N=C(NC1=O)CC2=C(C=C(C=C2)C)C)O

Isomeric SMILES

CCSCCC1=C(N=C(NC1=O)CC2=C(C=C(C=C2)C)C)O

InChI

InChI=1S/C17H22N2O2S/c1-4-22-8-7-14-16(20)18-15(19-17(14)21)10-13-6-5-11(2)9-12(13)3/h5-6,9H,4,7-8,10H2,1-3H3,(H2,18,19,20,21)