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

Systemtic Name: 4-[(2,5-dimethylphenyl)methylsulfanyl]-6-methyl-1H-pyrimidin-2-one Openeye Name: 4-[(2,5-dimethylphenyl)methylsulfanyl]-6-methyl-1H-pyrimidin-2-one CAS Name: 4-[(2,5-dimethylphenyl)methylthio]-6-methyl-1H-pyrimidin-2-one IUPAC Name: 4-[(2,5-dimethylphenyl)methylsulfanyl]-6-methyl-1H-pyrimidin-2-one Traditional Name: 4-[(2,5-dimethylbenzyl)thio]-6-methyl-1H-pyrimidin-2-one Formula: C14H16N2OS MolecularWeight: 260.35464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CSC2=NC(=O)NC(=C2)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)CSC2=NC(=O)NC(=C2)C

InChI

InChI=1S/C14H16N2OS/c1-9-4-5-10(2)12(6-9)8-18-13-7-11(3)15-14(17)16-13/h4-7H,8H2,1-3H3,(H,15,16,17)