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

Systemtic Name: 2-[(2,5-dimethylphenyl)methylsulfanyl]-5-ethyl-6-methyl-1H-pyrimidin-4-one Openeye Name: 2-[(2,5-dimethylphenyl)methylsulfanyl]-5-ethyl-6-methyl-1H-pyrimidin-4-one CAS Name: 2-[(2,5-dimethylphenyl)methylthio]-5-ethyl-6-methyl-1H-pyrimidin-4-one IUPAC Name: 2-[(2,5-dimethylphenyl)methylsulfanyl]-5-ethyl-6-methyl-1H-pyrimidin-4-one Traditional Name: 2-[(2,5-dimethylbenzyl)thio]-5-ethyl-6-methyl-1H-pyrimidin-4-one Formula: C16H20N2OS MolecularWeight: 288.4078

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(NC(=NC1=O)SCC2=C(C=CC(=C2)C)C)C

Isomeric SMILES

CCC1=C(NC(=NC1=O)SCC2=C(C=CC(=C2)C)C)C

InChI

InChI=1S/C16H20N2OS/c1-5-14-12(4)17-16(18-15(14)19)20-9-13-8-10(2)6-7-11(13)3/h6-8H,5,9H2,1-4H3,(H,17,18,19)