2-[2-[(3,5-dimethylphenyl)methoxy]ethylsulfanyl]-6-methyl-1H-pyrimidin-4-one

Systemtic Name: 2-[2-[(3,5-dimethylphenyl)methoxy]ethylsulfanyl]-6-methyl-1H-pyrimidin-4-one Openeye Name: 2-[2-[(3,5-dimethylphenyl)methoxy]ethylsulfanyl]-6-methyl-1H-pyrimidin-4-one CAS Name: 2-[2-[(3,5-dimethylphenyl)methoxy]ethylthio]-6-methyl-1H-pyrimidin-4-one IUPAC Name: 2-[2-[(3,5-dimethylphenyl)methoxy]ethylsulfanyl]-6-methyl-1H-pyrimidin-4-one Traditional Name: 2-[2-(3,5-dimethylbenzyl)oxyethylthio]-6-methyl-1H-pyrimidin-4-one Formula: C16H20N2O2S MolecularWeight: 304.4072

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)COCCSC2=NC(=O)C=C(N2)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)COCCSC2=NC(=O)C=C(N2)C)C

InChI

InChI=1S/C16H20N2O2S/c1-11-6-12(2)8-14(7-11)10-20-4-5-21-16-17-13(3)9-15(19)18-16/h6-9H,4-5,10H2,1-3H3,(H,17,18,19)